def __init__(self, master, selectM, lists, cbset):
MultiListbox.__init__(self, master, selectM, lists)
for l in self.lists:
l.bind('<Double-1>', self.editProp)
self.cbset = cbset
for b in self.cbset:
b.config(state=DISABLED)
def body(self, master):
# create canvas to hold scrollbar and listbox objects
emailListCanvas = Canvas(master, width=350, height=400)
emailListCanvas.config(scrollregion=emailListCanvas.bbox(ALL))
emailListCanvas.grid(column=0, sticky=W)
# create multiListbox to hold email list
self._emailListbox = MultiListbox(emailListCanvas,
(('Email', 160), ("", 1)),
command=self.deleteEmail)
for item in self.emailList:
self._emailListbox.insert(END, (item, ""))
self._emailListbox.grid(column=0, columnspan=3, sticky=W)
addButton = Button(emailListCanvas, text="Add", command=self.addEmail)
addButton.grid(row=1, column=0)
deleteButton = Button(emailListCanvas,
text="Delete",
command=self.deleteEmail)
deleteButton.grid(row=1, column=1)
helpButton = Button(emailListCanvas,
text="Help",
command=self.displayHelp)
helpButton.grid(row=1, column=2)
class PeopleList(Frame):
def __init__(self, master=None, title='', items=(('客户名称',36),('机构类型',10),('国别', 10),('营业执照编号',20),('注册资本',10)), next_func=None):
Frame.__init__(self, master, relief=Tkinter.GROOVE )
self.mutilistbox_items = items
self.next_func = next_func
self.next_func_button = None
self.title = title
self.create_widget()
def create_widget(self):
self.create_explain_label()
self.create_mutilistbox(self.mutilistbox_items)
self.create_button()
self.pack_all()
def create_explain_label(self):
self.explain_label = Label(self, text=self.title)
self.explain_label['width'] = 80
self.explain_label['anchor'] = 'w'
def refresh_mutilistbox(self):
self.people_mutilistbox.delete(0, self.people_mutilistbox.size())
self.add_item()
def add_item(self):
people_list = show_people_list()
for p in people_list:
self.people_mutilistbox.insert(Tkinter.END, p)
def get_mutilistbox_choose(self):
now = self.people_mutilistbox.curselection()
if not now:
return None
else:
return (const.people_information_list[int(now[0])], int(now[0]))
def create_mutilistbox(self, mutilistbox_items):
self.people_mutilistbox = MultiListbox(self, mutilistbox_items)
self.people_mutilistbox['width'] = 200
self.people_mutilistbox['height'] = 100
self.refresh_mutilistbox()
def create_button(self):
self.add_people_button = Button(self, text='增加新客户')
self.add_people_button['command'] = lambda: PeopleInformationToplevel(self)
self.confirm_button = Button(self, text='刷新')
self.confirm_button['command'] = self.refresh_mutilistbox
if self.next_func:
self.next_func_button = Button(self, text='填写申请')
self.next_func_button['command'] = self.next_func
def pack_all(self):
self.explain_label.pack()
self.people_mutilistbox.pack(fill=Tkinter.BOTH)
self.confirm_button.pack(side=Tkinter.RIGHT)
self.add_people_button.pack(side=Tkinter.RIGHT)
if self.next_func_button:
self.next_func_button.pack(side=Tkinter.LEFT)
class Message(Show_style):
def __init__(self, master=None):
Show_style.__init__(self, master)
self.add_status()
self.create_widget()
self.pack_all()
def create_widget(self):
self.create_main_frame()
def create_main_frame(self):
self.main_labelframe = LabelFrame(self, text='消息中心')
self.main_list_item = (('业务编号',10),('客户编号',8),('客户名称',20),('发放日',10),('到期日',10),('贷款金额',5),('产品名称',10),('期限', 5),('利率',8), ('申请状态', 14))
self.main_list = MultiListbox(self.main_labelframe, self.main_list_item, height=22)
self.main_list.grid(padx=10, pady=10, row=0, column=0)
self.check_button = Button(self.main_labelframe, text='察看')
def check_func():
apply_information = self.get_mutilistbox_choose()
if not apply_information:
MessageBox('当前申请', '请先选中一个申请消息')
return
self.apply_information_toplevel = ApplyInformationToplevel(self, apply_information)
self.check_button['command'] = check_func
self.check_button.grid(pady=10, row=1, column=0)
def get_mutilistbox_choose(self):
now = self.main_list.curselection()
if not now:
return None
else:
print 'now', self.main_list.get(now)
number = self.main_list.get(now)[0]
#return const.apply_information_list[int(now[0])]
for apply_information in const.apply_information_list:
if apply_information[15] == number:
return apply_information
def refresh_mutilistbox(self):
self.main_list.delete(0, self.main_list.size())
self.add_item()
def add_item(self):
apply_list = show_apply_list()
for p in apply_list:
now_state = int(p[-1])
if now_state >= 5:
p[-1] = '审核通过'
elif now_state > int(const.user_type):
p[-1] = '等待上级审核'
elif now_state == int(const.user_type):
p[-1] = '等待当前用户审核'
elif now_state < int(const.user_type):
continue
self.main_list.insert(Tkinter.END, p)
def pack_all(self):
self.main_labelframe.pack()
class Main(Frame):
def __init__(self, master=None):
Frame.__init__(self, master)
self.filename = None
self.target_select_value = Tkinter.StringVar()
self.search_string = Tkinter.StringVar()
self.create_widget()
self.pack_all()
def create_widget(self):
self.target_mlb = MultiListbox(self, (('mRNAname', 20),('score',20)), height=25)
self.function_mlb = MultiListbox(self, (('target family', 20),('function',20)), height=25)
self.RNA_in_input = SearchInput(self, text='输入microRNA名字:',
textvariable=self.search_string,
button_function=lambda:get_result(self.search_string, self.target_select_value, self.target_mlb, self.function_mlb))
self.split_frame = Frame(self, height=1, width=680, bg='black')
self.split_frame_2 = Frame(self, height=1, width=680, bg='black')
self.query_target_label = Label(self, text='查询target')
self.query_function_label = Label(self, text='查询功能')
self.target_select_radiobutton = []
self.target_select_radiobutton.append(Radiobutton(self,
variable = self.target_select_value,
value = 'targetscan', text = 'targetscan'))
self.target_select_radiobutton.append(Radiobutton(self,
variable = self.target_select_value,
value = 'miRanda', text = 'miRanda'))
self.target_select_radiobutton.append(Radiobutton(self,
variable = self.target_select_value,
value = 'picTar', text = 'picTar'))
for radiobutton in self.target_select_radiobutton:
radiobutton['width'] = 6
def pack_all(self):
self.RNA_in_input.grid(pady=10,row=0, column=0, columnspan=5)
self.split_frame.grid(pady=5,row=1, column=0, columnspan=5)
self.query_target_label.grid(pady=5, row=2, column=0, columnspan=3)
self.query_function_label.grid(pady=5, row=2, column=3, columnspan=2)
for i, radiobutton in enumerate(self.target_select_radiobutton):
radiobutton.grid(pady=5, row=3, column=i)
self.target_select_radiobutton[0].select()
for i in range(2):
Label(self, width=8).grid(pady=5, row=3, column=3+i)
self.split_frame_2.grid(pady=5,row=4, column=0, columnspan=5)
self.target_mlb.grid(pady=10, row=5, column=0, columnspan=3)
self.function_mlb.grid(pady=10, row=5, column=3, columnspan=2)
"""
def body(self, master):
# create canvas to hold scrollbar and listbox objects
emailListCanvas = Canvas(master, width=350, height=400)
emailListCanvas.config(scrollregion=emailListCanvas.bbox(ALL))
emailListCanvas.grid(column=0, sticky=W)
# create multiListbox to hold email list
self._emailListbox = MultiListbox(emailListCanvas,
(('Email', 160), ('Image Only', 70)),
command = self.deleteEmail)
if len(self.emailList) != 0:
for item in self.emailList:
item = item[ :-1]
item = item.split(",")
self._emailListbox.insert(END, (item[0], item[1]))
self._emailListbox.grid(column = 0,columnspan=3, sticky=W)
addButton = Button(emailListCanvas, text="Add",command=self.addEmail)
addButton.grid(row=1,column=0)
deleteButton = Button(emailListCanvas, text="Delete",command=self.deleteEmail)
deleteButton.grid(row=1,column=1)
helpButton = Button(emailListCanvas, text="Help", command = self.displayHelp)
helpButton.grid(row=1,column=2)
# create canvas to hold admin email information
adminEmailCanvas = Canvas(master)
adminEmailCanvas.grid(column=1)
Label(master, text="The administrator email will receive\nall information regarding all alerts",
fg="green",bg="black").grid(column=1, row=0)
self.adminEmailDisplay = Label(master, text=self.adminEmail)
self.adminEmailDisplay.grid(column=1,row=1)
def initUI(self):
self.parent.title("Typesetting")
self.min_margin = 10
self.max_margin = 100
self.margin_value = self.min_margin
self.words = []
menubar = Menu(self.parent)
self.parent.config(menu=menubar)
fileMenu = Menu(menubar)
fileMenu.add_command(label="Open", command=self.openfile)
fileMenu.add_command(label="Clear", command=self.clear)
fileMenu.add_separator()
fileMenu.add_command(label="Exit", command=self.onExit)
menubar.add_cascade(label="File", menu=fileMenu)
grid = Frame(self.parent)
left_grid = Frame(grid)
w_list_label = Label(left_grid,text="Lista de palabras")
w_list_label.pack(side=TOP)
self.w_list = MultiListbox(left_grid,(("Palabra",20),("Longitud",10)))
self.w_list.pack(side=BOTTOM,fill=BOTH,expand=TRUE)
left_grid.pack(side=LEFT,fill=BOTH,expand=TRUE)
right_grid = Frame(grid)
up_grid = Frame(right_grid)
margin_label = Label(up_grid,text="Margen")
margin_label.pack(side=LEFT,expand=TRUE)
self.margin_scale = Scale(up_grid,orient=HORIZONTAL,showvalue=0,\
variable=self.margin_value,from_=self.min_margin,to=self.max_margin,
command=self.refresh_margin)
self.margin_scale.pack(side=LEFT)
self.margin_spinbox = Spinbox(up_grid,\
textvariable=self.margin_value,from_=self.min_margin,to=self.max_margin)
self.margin_spinbox.pack(side=LEFT)
typeset_btn = Button(up_grid, text ="Typeset", command =self.typeset)
typeset_btn.pack(side=RIGHT)
up_grid.pack(side=TOP)
self.text = Text(right_grid)
self.text.pack(side=BOTTOM,fill=BOTH,expand=TRUE)
right_grid.pack(side=RIGHT,fill=BOTH)
grid.pack(fill=BOTH, expand=YES)
def help(self):
hwin = Toplevel(self.win)
hwin.title('Help')
npanel = LabelFrame(hwin, text='NAME table', padx=0, pady=0, width=100, height=100)
nlist = MultiListbox(npanel, 'SINGLE', (('FIELD', 20), ('Type', 15), ('Null', 5), ('Key', 5), ('Default', 10), ('Extra', 20)))
dname = self.execute("DESCRIBE NAME")
rname = dname.fetchall()
for r in rname:
nlist.insert(END, r)
nlist.pack(fill=Y)
npanel.pack()
ppanel = npanel = LabelFrame(hwin, text='PROPERTY table', padx=0, pady=0, width=100, height=100)
plist = MultiListbox(ppanel, 'SINGLE', (('FIELD', 20), ('Type', 15), ('Null', 5), ('Key', 5), ('Default', 10), ('Extra', 20)))
dprop = self.execute("DESCRIBE PROPERTY")
rprop = dprop.fetchall()
for r in rprop:
plist.insert(END, r)
plist.pack(fill=Y)
ppanel.pack()
def __init__(self, name, prop, option, parent=None):
self.win = Toplevel()
self.win.title=('Duplicate Card Exists')
Label(self.win, text=name).pack(side=TOP)
ppanel = MultiListbox(self.win, 'SINGLE', (('Property Name', 20), ('Type Parameter', 35), ('Value Parameter', 35), ('Value', 55)))
for p in prop:
ppanel.insert(END, (p[0], p[1], p[2], p[3]))
ppanel.pack(side=TOP, fill=BOTH)
bpanel = Frame(self.win)
Label(bpanel, text='What would you like to do?').pack(side=TOP, fill=X)
self.var = StringVar()
self.option = option
Radiobutton(bpanel, text="Don't store this card", variable=self.var, value="Skip").pack(anchor=NW)
Radiobutton(bpanel, text="Replace this card", variable=self.var, value="Replace").pack(anchor=NW)
Radiobutton(bpanel, text="Merge with this card",variable=self.var, value="Merge").pack(anchor=NW)
Radiobutton(bpanel, text="Cancel storing",variable=self.var, value="Cancel").pack(anchor=NW)
Button(bpanel, text="OK", command= lambda: self.get()).pack(side=RIGHT)
bpanel.pack(side=LEFT)
self.var.set("Skip")
self.win.focus_set()
self.win.grab_set()
self.win.wait_window()
def create_widget(self):
self.target_mlb = MultiListbox(self, (('mRNAname', 20),('score',20)), height=25)
self.function_mlb = MultiListbox(self, (('target family', 20),('function',20)), height=25)
self.RNA_in_input = SearchInput(self, text='输入microRNA名字:',
textvariable=self.search_string,
button_function=lambda:get_result(self.search_string, self.target_select_value, self.target_mlb, self.function_mlb))
self.split_frame = Frame(self, height=1, width=680, bg='black')
self.split_frame_2 = Frame(self, height=1, width=680, bg='black')
self.query_target_label = Label(self, text='查询target')
self.query_function_label = Label(self, text='查询功能')
self.target_select_radiobutton = []
self.target_select_radiobutton.append(Radiobutton(self,
variable = self.target_select_value,
value = 'targetscan', text = 'targetscan'))
self.target_select_radiobutton.append(Radiobutton(self,
variable = self.target_select_value,
value = 'miRanda', text = 'miRanda'))
self.target_select_radiobutton.append(Radiobutton(self,
variable = self.target_select_value,
value = 'picTar', text = 'picTar'))
for radiobutton in self.target_select_radiobutton:
radiobutton['width'] = 6
def create_main_frame(self):
self.main_labelframe = LabelFrame(self, text='消息中心')
self.main_list_item = (('业务编号', 10), ('客户编号', 8), ('客户名称', 20),
('发放日', 10), ('到期日', 10), ('贷款金额', 5),
('产品名称', 10), ('期限', 5), ('利率', 8), ('申请状态',
14))
self.main_list = MultiListbox(self.main_labelframe,
self.main_list_item,
height=22)
self.main_list.grid(padx=10, pady=10, row=0, column=0)
self.check_button = Button(self.main_labelframe, text='察看')
def check_func():
apply_information = self.get_mutilistbox_choose()
if not apply_information:
MessageBox('当前申请', '请先选中一个申请消息')
return
self.apply_information_toplevel = ApplyInformationToplevel(
self, apply_information)
self.check_button['command'] = check_func
self.check_button.grid(pady=10, row=1, column=0)
def create_main_frame(self):
self.main_labelframe = LabelFrame(self, text='消息中心')
self.main_list_item = (('业务编号',10),('客户编号',8),('客户名称',20),('发放日',10),('到期日',10),('贷款金额',5),('产品名称',10),('期限', 5),('利率',8), ('申请状态', 14))
self.main_list = MultiListbox(self.main_labelframe, self.main_list_item, height=22)
self.main_list.grid(padx=10, pady=10, row=0, column=0)
self.check_button = Button(self.main_labelframe, text='察看')
def check_func():
apply_information = self.get_mutilistbox_choose()
if not apply_information:
MessageBox('当前申请', '请先选中一个申请消息')
return
self.apply_information_toplevel = ApplyInformationToplevel(self, apply_information)
self.check_button['command'] = check_func
self.check_button.grid(pady=10, row=1, column=0)
def body(self, master):
# create canvas to hold scrollbar and listbox objects
emailListCanvas = Canvas(master, width=350, height=400)
emailListCanvas.config(scrollregion=emailListCanvas.bbox(ALL))
emailListCanvas.grid(column=0, sticky=W)
# create multiListbox to hold email list
self._emailListbox = MultiListbox(emailListCanvas,
(('Email', 160),("",1)),
command = self.deleteEmail)
for item in self.emailList:
self._emailListbox.insert(END, (item,""))
self._emailListbox.grid(column = 0,columnspan=3, sticky=W)
addButton = Button(emailListCanvas, text="Add",command=self.addEmail)
addButton.grid(row=1,column=0)
deleteButton = Button(emailListCanvas, text="Delete",command=self.deleteEmail)
deleteButton.grid(row=1,column=1)
helpButton = Button(emailListCanvas, text="Help", command = self.displayHelp)
helpButton.grid(row=1,column=2)
class EmailSettings(Toplevel):
def __init__(self, parent):
Toplevel.__init__(self, parent, height=400, width=700)
#self.pack_propagate(0)
self.transient(parent)
self.title("VSAS - Email Settings")
self._parent = parent
self.adminEmail=""
emailFile = open("vsasGUI/emailTester.txt","r")
self.emailList = emailFile.readlines()
emailFile.close()
body = Frame(self, bg="black")
self._initialFocus = self.body(body)
body.pack_propagate(0)
body.pack(padx=5,pady=5)
self.buttonBox()
self.current=None
self.grab_set()
self.bind("<F1>",self.displayHelp)
if not self._initialFocus:
self._initialFocus = self
self.protocol("WM_DELETE_WINDOW", self.cancel)
self.geometry("+%d+%d" % (parent.winfo_rootx()+50,
parent.winfo_rooty()+50))
self._initialFocus.focus_set()
self._parent.wait_window(self)
def body(self, master):
# create canvas to hold scrollbar and listbox objects
emailListCanvas = Canvas(master, width=350, height=400)
emailListCanvas.config(scrollregion=emailListCanvas.bbox(ALL))
emailListCanvas.grid(column=0, sticky=W)
# create multiListbox to hold email list
self._emailListbox = MultiListbox(emailListCanvas,
(('Email', 160),("",1)),
command = self.deleteEmail)
for item in self.emailList:
self._emailListbox.insert(END, (item,""))
self._emailListbox.grid(column = 0,columnspan=3, sticky=W)
addButton = Button(emailListCanvas, text="Add",command=self.addEmail)
addButton.grid(row=1,column=0)
deleteButton = Button(emailListCanvas, text="Delete",command=self.deleteEmail)
deleteButton.grid(row=1,column=1)
helpButton = Button(emailListCanvas, text="Help", command = self.displayHelp)
helpButton.grid(row=1,column=2)
#Label(master, text="The administrator email will receive\nall information regarding all alerts",
#fg="green",bg="black").grid(column=1, row=0)
#self.adminEmailDisplay = Label(master, text=self.adminEmail)
#self.adminEmailDisplay.grid(column=1, row=1)
def buttonBox(self):
pass
def addEmail(self):
email = EmailInput(self, title="Add Email").get()
if len(email)>0:
emailFile = open("vsasGUI/emailTester.txt","a")
#emailComposite = email.split(",")
#emailTuple = (emailComposite[0], emailComposite[1])
print email
email = email+"\n"
self.emailList.append(email)
emailFile.write(email)
emailFile.close()
self._emailListbox.insert(END, (email,""))
self.update()
def deleteEmail(self, event=None):
if MsgBox.askyesno("Delete Email?","Are you sure you want to delete selected email?"):
index = self.emailList[eval(self._emailListbox.curselection()[0])]
self.emailList.remove(index)
self._emailListbox.delete(0,END)
emailFile = open("vsasGUI/emailTester.txt","w")
for item in self.emailList:
emailFile.write(item)
self._emailListbox.insert(END, (item,""))
emailFile.close()
def displayHelp(self, event=None):
helpText = open("vsasGUI/EmailScreenHelp.txt","r").read()
MsgBox.showinfo(title="VSAS Email Settings - Help", message=helpText)
def cancel(self, event=None):
if MsgBox.askyesno("Done?",
"All changes have been saved.\nReturn to VSAS Main?"):
self._parent.focus_set()
self.destroy()
def create_mutilistbox(self, mutilistbox_items):
self.people_mutilistbox = MultiListbox(self, mutilistbox_items)
self.people_mutilistbox['width'] = 200
self.people_mutilistbox['height'] = 100
self.refresh_mutilistbox()
class PeopleList(Frame):
def __init__(self,
master=None,
title='',
items=(('客户名称', 36), ('机构类型', 10), ('国别', 10), ('营业执照编号', 20),
('注册资本', 10)),
next_func=None):
Frame.__init__(self, master, relief=Tkinter.GROOVE)
self.mutilistbox_items = items
self.next_func = next_func
self.next_func_button = None
self.title = title
self.create_widget()
def create_widget(self):
self.create_explain_label()
self.create_mutilistbox(self.mutilistbox_items)
self.create_button()
self.pack_all()
def create_explain_label(self):
self.explain_label = Label(self, text=self.title)
self.explain_label['width'] = 80
self.explain_label['anchor'] = 'w'
def refresh_mutilistbox(self):
self.people_mutilistbox.delete(0, self.people_mutilistbox.size())
self.add_item()
def add_item(self):
people_list = show_people_list()
for p in people_list:
self.people_mutilistbox.insert(Tkinter.END, p)
def get_mutilistbox_choose(self):
now = self.people_mutilistbox.curselection()
if not now:
return None
else:
return (const.people_information_list[int(now[0])], int(now[0]))
def create_mutilistbox(self, mutilistbox_items):
self.people_mutilistbox = MultiListbox(self, mutilistbox_items)
self.people_mutilistbox['width'] = 200
self.people_mutilistbox['height'] = 100
self.refresh_mutilistbox()
def create_button(self):
self.add_people_button = Button(self, text='增加新客户')
self.add_people_button['command'] = lambda: PeopleInformationToplevel(
self)
self.confirm_button = Button(self, text='刷新')
self.confirm_button['command'] = self.refresh_mutilistbox
if self.next_func:
self.next_func_button = Button(self, text='填写申请')
self.next_func_button['command'] = self.next_func
def pack_all(self):
self.explain_label.pack()
self.people_mutilistbox.pack(fill=Tkinter.BOTH)
self.confirm_button.pack(side=Tkinter.RIGHT)
self.add_people_button.pack(side=Tkinter.RIGHT)
if self.next_func_button:
self.next_func_button.pack(side=Tkinter.LEFT)
def __init__(self, master, selectM, lists, cvp, updateCVP, menu): MultiListbox.__init__(self, master, selectM, lists) self.updateCVP = updateCVP self.cvp = cvp self.menu = menu
class Program(Frame):
def __init__(self, parent):
Frame.__init__(self, parent)
self.parent = parent
self.initUI()
def initUI(self):
self.parent.title("Typesetting")
self.min_margin = 10
self.max_margin = 100
self.margin_value = self.min_margin
self.words = []
menubar = Menu(self.parent)
self.parent.config(menu=menubar)
fileMenu = Menu(menubar)
fileMenu.add_command(label="Open", command=self.openfile)
fileMenu.add_command(label="Clear", command=self.clear)
fileMenu.add_separator()
fileMenu.add_command(label="Exit", command=self.onExit)
menubar.add_cascade(label="File", menu=fileMenu)
grid = Frame(self.parent)
left_grid = Frame(grid)
w_list_label = Label(left_grid,text="Lista de palabras")
w_list_label.pack(side=TOP)
self.w_list = MultiListbox(left_grid,(("Palabra",20),("Longitud",10)))
self.w_list.pack(side=BOTTOM,fill=BOTH,expand=TRUE)
left_grid.pack(side=LEFT,fill=BOTH,expand=TRUE)
right_grid = Frame(grid)
up_grid = Frame(right_grid)
margin_label = Label(up_grid,text="Margen")
margin_label.pack(side=LEFT,expand=TRUE)
self.margin_scale = Scale(up_grid,orient=HORIZONTAL,showvalue=0,\
variable=self.margin_value,from_=self.min_margin,to=self.max_margin,
command=self.refresh_margin)
self.margin_scale.pack(side=LEFT)
self.margin_spinbox = Spinbox(up_grid,\
textvariable=self.margin_value,from_=self.min_margin,to=self.max_margin)
self.margin_spinbox.pack(side=LEFT)
typeset_btn = Button(up_grid, text ="Typeset", command =self.typeset)
typeset_btn.pack(side=RIGHT)
up_grid.pack(side=TOP)
self.text = Text(right_grid)
self.text.pack(side=BOTTOM,fill=BOTH,expand=TRUE)
right_grid.pack(side=RIGHT,fill=BOTH)
grid.pack(fill=BOTH, expand=YES)
def onExit(self):
self.quit()
def openfile(self):
filename = askopenfilename(parent=self.parent)
lines = [line.rstrip('\n') for line in open(filename,'r')]
self.words = []
for line in lines:
self.words.extend(line.split(' '))
for word in self.words:
self.insert_list(word)
def refresh_margin(self,value):
self.margin_value=value
def get_margin(self):
return int(self.margin_value)
def typeset(self):
try:
self.clear_text()
text = typeset(self.words,self.get_margin())
self.insert_text(text)
except IOError as e:
tkMessageBox.showwarning(
"Exception",
e )
def clear_text(self):
self.text.delete("%d.%d"%(0,0),END)
def insert_text(self,texto):
self.text.insert(INSERT,texto)
def clear_list(self):
self.w_list.delete(0,END)
pass
def insert_list(self,word):
self.w_list.insert(END,(word,len(word)))
pass
def clear(self):
self.clear_list()
self.clear_text()
class Message(Show_style):
def __init__(self, master=None):
Show_style.__init__(self, master)
self.add_status()
self.create_widget()
self.pack_all()
def create_widget(self):
self.create_main_frame()
def create_main_frame(self):
self.main_labelframe = LabelFrame(self, text='消息中心')
self.main_list_item = (('业务编号', 10), ('客户编号', 8), ('客户名称', 20),
('发放日', 10), ('到期日', 10), ('贷款金额', 5),
('产品名称', 10), ('期限', 5), ('利率', 8), ('申请状态',
14))
self.main_list = MultiListbox(self.main_labelframe,
self.main_list_item,
height=22)
self.main_list.grid(padx=10, pady=10, row=0, column=0)
self.check_button = Button(self.main_labelframe, text='察看')
def check_func():
apply_information = self.get_mutilistbox_choose()
if not apply_information:
MessageBox('当前申请', '请先选中一个申请消息')
return
self.apply_information_toplevel = ApplyInformationToplevel(
self, apply_information)
self.check_button['command'] = check_func
self.check_button.grid(pady=10, row=1, column=0)
def get_mutilistbox_choose(self):
now = self.main_list.curselection()
if not now:
return None
else:
print 'now', self.main_list.get(now)
number = self.main_list.get(now)[0]
#return const.apply_information_list[int(now[0])]
for apply_information in const.apply_information_list:
if apply_information[15] == number:
return apply_information
def refresh_mutilistbox(self):
self.main_list.delete(0, self.main_list.size())
self.add_item()
def add_item(self):
apply_list = show_apply_list()
for p in apply_list:
now_state = int(p[-1])
if now_state >= 5:
p[-1] = '审核通过'
elif now_state > int(const.user_type):
p[-1] = '等待上级审核'
elif now_state == int(const.user_type):
p[-1] = '等待当前用户审核'
elif now_state < int(const.user_type):
continue
self.main_list.insert(Tkinter.END, p)
def pack_all(self):
self.main_labelframe.pack()
def selection_set(self, first, last=None): MultiListbox.selection_set(self, first, last) self.updateCVP(self.cvp, self.curselection()) self.menu.entryconfig(3, state=NORMAL)
def selection_clear(self, first, last=None): MultiListbox.selection_clear(self, first, last) self.updateCVP(self.cvp, self.curselection()) self.menu.entryconfig(3, state=DISABLED)
class MApp(tk.Frame):
#----------------------------------------------------------------------
def __init__(self, parent):
"""Constructor"""
tk.Frame.__init__(self,parent)
self.parent = parent
self.parent.title('MDff GUI'+"~")
w, h = self.parent.winfo_screenwidth(), root.winfo_screenheight()
self.parent.geometry("%dx%d+0+0" % (w, h))
self.pack()
self.global_path='/home/filipe/dev/github/mdff'
self.doc_path=self.global_path+'/doc'
self.exe_path=tk.StringVar(None)
self.exe_path.set(find_executable('mdff.x'))
self.control_path=tk.StringVar(None)
self.control_path.set('./control.F')
self.posff_path=tk.StringVar(None)
self.posff_path.set('./POSFF')
self.stdout_path=tk.StringVar(None)
self.stdout_path.set('./log')
self.running=True
self._create_panel_files()
self._create_panel_run()
self._create_menu()
# shortscut
self.parent.bind_all("<Control-w>", self._quit)
self.parent.bind_all("<Control-s>", self._save)
self.parent.bind_all("<Control-x>", self.start_exe)
self.parent.bind_all("<Control-k>", self._kill_exe)
self.run_frame = None
self.plot_frame = None
self.config_frame = None
self.control_md_frame = None
#----------------------------------------------------------------------
def _create_menu(self):
self.menubar = tk.Menu(self)
menuFile = tk.Menu(self,tearoff=0)
menuCreate = tk.Menu(menuFile,tearoff=0)
menuCreate.add_command(label="full",command=lambda :self._create_control_file("full"))
menuCreate.add_command(label="empty",command=lambda :self._create_control_file("empty"))
menuCreate.add_command(label="md",command=lambda :self._create_control_file("md"))
menuCreate.add_command(label="opt",command=lambda :self._create_control_file("opt"))
menuCreate.add_command(label="stochio",command=lambda :self._create_control_file("stochio"))
menuFile.add_cascade(label="New control file",menu=menuCreate,underline=0)
menuFile.add_command(label="New POSFF file",command=self._create_posff_file)
menuFile.add_command(label="Save as",command=self._save_as)
menuFile.add_separator()
menuFile.add_command(label="Quit",command=self.parent.destroy, accelerator="Ctrl+w")
self.menubar.add_cascade(label="File", menu=menuFile)
menuExe = tk.Menu(self,tearoff=0)
menuExe.add_command(label="Select control file", command=self._select_control_file)
menuExe.add_command(label="Select POSFF file", command=self._select_posff_file)
menuExe.add_command(label="Select executable",command=self._select_exe)
menuExe.add_command(label="Execute",command=self._start_exe, accelerator="Ctrl+x")
self.menubar.add_cascade(label="Run", menu=menuExe)
menuAnalysis = tk.Menu(self,tearoff=0)
menuAnalysis.add_command(label="Thermodynamic plots", command=self._run_stat)
menuAnalysis.add_command(label="Radial Distribution Function", command=self._select_posff_file)
self.menubar.add_cascade(label="Analysis", menu=menuAnalysis)
menuHelp = tk.Menu(self,tearoff=0)
menuHelp.add_command(label="Documentation",command=self._doc)
menuHelp.add_command(label="About",command=self._apropos)
self.menubar.add_cascade(label="Help", menu=menuHelp)
try:
self.parent.config(menu=self.menubar)
except AttributeError:
self.parent.call(parent, "config", "-menu", self.menubar)
#----------------------------------------------------------------------
def _create_panel_run(self):
self.run_frame = tk.Frame(self.parent, name='run_frame')
self.run_frame.pack(side=tk.TOP,fill=tk.X)
lbl=tk.LabelFrame(self.run_frame,text="Input general information ", container=False,width=1000)
# lbl.grid(row=0, column=0,sticky=tk.W+tk.E,padx=5,pady=10)
lbl.pack(side=tk.TOP,fill=tk.X,padx=10,pady=10)
# control file
lc = tk.Label(lbl, text="current control file : " ,justify = tk.LEFT)
lc.grid(row=0,column=0,sticky=tk.W,padx=5)
mc=tk.Message(lbl, textvariable=self.control_path , justify=tk.LEFT,width=1000)
mc.grid(row=0,column=1,sticky=tk.W,pady=1,padx=5)
# POSFF file
lp = tk.Label(lbl, text="current config file : ",justify = tk.LEFT)
lp.grid(row=1,column=0,sticky=tk.W,padx=5)
mp=tk.Message(lbl, textvariable=self.posff_path , justify=tk.LEFT,width=1000)
mp.grid(row=1,column=1,sticky=tk.W,pady=1,padx=5)
# stdout file
ls = tk.Label(lbl, text="standard output (std): ",justify = tk.LEFT)
ls.grid(row=2,column=0,sticky=tk.W,padx=5)
ms=tk.Message(lbl, textvariable=self.stdout_path , justify=tk.LEFT,width=1000)
ms.grid(row=2,column=1,sticky=tk.W,pady=1,padx=5)
# exe file
lx = tk.Label(lbl, text="executable path : ",justify = tk.LEFT)
lx.grid(row=3,column=0,sticky=tk.W,padx=5)
mx=tk.Message(lbl, textvariable=self.exe_path , justify=tk.LEFT,width=1000)
mx.grid(row=3,column=1,sticky=tk.W,pady=1,padx=5)
#----------------------------------------------------------------------
def _create_panel_files(self):
self.files_frame = tk.Frame(self.parent, name='files_frame')
self.files_frame.pack(side=tk.LEFT,fill=tk.Y)
# create the notebook
self.nb = ttk.Notebook(self.files_frame, name='notebook')
# extend bindings to top level window allowing
# CTRL+TAB - cycles thru tabs
# SHIFT+CTRL+TAB - previous tab
# ALT+K - select tab using mnemonic (K = underlined letter)
self.nb.enable_traversal()
self.nb.pack(side=tk.LEFT,fill=tk.Y)
self._create_control_tab()
self._create_posff_tab()
self._create_stdout_tab()
#----------------------------------------------------------------------
def _create_stdout_tab(self):
self.frame_stdout = tk.Frame(self.nb, name='log')
self.frame_stdout.pack(side=tk.LEFT,fill=tk.Y)
self.nb.add(self.frame_stdout, text='log', underline=0)
self.txt_stdout = tk.Text(self.frame_stdout,width=100,height=44)#,background="gray50")
vscroll = ttk.Scrollbar(self.frame_stdout, orient=tk.VERTICAL, command=self.txt_stdout.yview)
self.txt_stdout['yscroll'] = vscroll.set
self.txt_stdout.grid(row=0,column=0,sticky=tk.W)
vscroll.grid(row=0, column=1,sticky=tk.N+tk.S,padx=5)
#----------------------------------------------------------------------
def _create_control_tab(self):
self.frame_control = tk.Frame(self.nb, name='control')
self.frame_control.pack(side=tk.LEFT,fill=tk.Y)
self.nb.add(self.frame_control, text='control.F', underline=0)
self.txt_control = tk.Text(self.frame_control,width=100,height=44,undo=True)#,background="gray50")
vscroll = ttk.Scrollbar(self.frame_control, orient=tk.VERTICAL, command=self.txt_control.yview)
self.txt_control['yscroll'] = vscroll.set
self.txt_control.grid(row=0, column=0,sticky=tk.N+tk.S)
vscroll.grid(row=0, column=1,sticky=tk.N+tk.S,padx=5)
self.txt_control.tag_configure("tag", foreground="navy")
self.txt_control.tag_configure("int", foreground="red")
self.txt_control.tag_configure("tag2", foreground='green4')
self.txt_control.tag_configure("comment", foreground="black")
self.txt_control.bind("<Any-KeyRelease>", self.highlight_control)
self.txt_control.bind("<Any-ButtonRelease>", self.highlight_control)
file = open(self.control_path.get(), 'a+')
if file != None:
content = file.read()
self.txt_control.delete('1.0','end')
self.txt_control.insert('1.0',content)
file.close()
self.txt_control.update()
#----------------------------------------------------------------------
def highlight_control(self, event=None):
'''
put some colors on control panel
'''
#tags highlight
counts = []
self.txt_control.tag_remove("tag", "1.0", "end")
keys = ["controltag","mdtag","fieldtag","stochiotag","end"]
for key in keys:
counts.append(tk.IntVar())
self.txt_control.mark_set("matchStart", "1.0")
self.txt_control.mark_set("matchEnd", "1.0")
while True:
index = self.txt_control.search(key, "matchEnd","end", count=counts[-1])
if index == "" : break # no match was found
self.txt_control.mark_set("matchStart", index)
self.txt_control.mark_set("matchEnd", "%s+%sc" % (index, counts[-1].get()))
self.txt_control.tag_add("tag", "matchStart", "matchEnd")
#values (numbers, boolean)
counts = []
self.txt_control.tag_remove("int", "1.0", "end")
keys = ["1","2",'3','4','5','6','7','8','9','0','d0','_dp','.true.','.false.'] + all_values_allowed
for key in keys:
counts.append(tk.IntVar())
self.txt_control.mark_set("matchStart", "1.0")
self.txt_control.mark_set("matchEnd", "1.0")
while True:
index = self.txt_control.search(key, "matchEnd","end", count=counts[-1])
if index == "" : break # no match was found
self.txt_control.mark_set("matchStart", index)
self.txt_control.mark_set("matchEnd", "%s+%sc" % (index, counts[-1].get()))
self.txt_control.tag_add("int", "matchStart", "matchEnd")
# parameters name
counts = []
self.txt_control.tag_remove("tag2", "1.0", "end")
keys = namelist_all
for key in keys:
counts.append(tk.IntVar())
self.txt_control.mark_set("matchStart", "1.0")
self.txt_control.mark_set("matchEnd", "1.0")
while True:
index = self.txt_control.search(key, "matchEnd","end", count=counts[-1])
if index == "" : break # no match was found
self.txt_control.mark_set("matchStart", index)
self.txt_control.mark_set("matchEnd", "%s+%sc" % (index, counts[-1].get()))
self.txt_control.tag_add("tag2", "matchStart", "matchEnd")
#comments
self.txt_control.tag_remove("comment", "1.0", tk.END)
counts=tk.IntVar()
self.txt_control.mark_set("matchStart", "1.0")
self.txt_control.mark_set("matchEnd", "1.0")
while True:
index = self.txt_control.search("!", "matchEnd","end", count=counts)
if index == "" : break
self.txt_control.mark_set("matchStart", index)
self.txt_control.mark_set("matchEnd", "%s %s" % (index, "lineend"))
self.txt_control.tag_add("comment", "matchStart" , "matchEnd")
#----------------------------------------------------------------------
def _create_posff_tab(self):
self.frame_posff = tk.Frame(self.nb, name='posff')
self.frame_posff.pack(side=tk.LEFT,fill=tk.Y)
self.nb.add(self.frame_posff, text='POSFF', underline=0)
self.txt_posff = tk.Text(self.frame_posff, width=100,height=44,wrap=tk.NONE)#,background="gray50")
yscroll = ttk.Scrollbar(self.frame_posff, orient=tk.VERTICAL, command=self.txt_posff.yview)
xscroll = ttk.Scrollbar(self.frame_posff, orient=tk.HORIZONTAL, command=self.txt_posff.xview)
self.txt_posff['yscroll'] = yscroll.set
self.txt_posff['xscroll'] = xscroll.set
self.txt_posff.grid(row=0,column=0,sticky=tk.W)
xscroll.grid(row=1,column=0,sticky=tk.W+tk.E,pady=5)
yscroll.grid(row=0,column=2,sticky=tk.N+tk.S,padx=5)
file = open(self.posff_path.get(), 'rb')
if file != None:
content = file.read()
self.txt_posff.delete('1.0','end')
self.txt_posff.insert('1.0',content)
file.close()
#----------------------------------------------------------------------
def _create_control_file(self,calc):
filename='control_'+calc+'.F'
if calc in ["full",'empty','stochio'] :
get_control_file(calc,default_values,None,default_values,None,default_values,None)
file = open(filename, 'rb')
if file != None:
content = file.read()
self.txt_control.delete('1.0','end')
self.txt_control.insert('1.0',content)
file.close()
elif calc == "md":
self.md_values = default_values.copy()
self.field_values = default_values.copy()
self.control_values = default_values.copy()
# remove possible frame in the same region
if self.plot_frame is not None :
self.plot_frame.destroy()
if self.config_frame is not None :
self.config_frame .destroy()
self.control_md_frame = tk.Frame(self.parent, name='control_md_frame')
self.control_md_frame.pack(side=tk.LEFT,fill=tk.BOTH)
# mainlabel = tk.Label(self.control_md_frame, text="Construct control.F for calc='md' \n(mind only few parameters can be access from this GUI)")
# mainlabel.grid(row=0,column=0,sticky=tk.W+tk.E,pady=5,padx=10)
# integrator
lintegrator = tk.Label(self.control_md_frame, text="integrator")
lintegrator.grid(row=1,column=0,sticky=tk.W+tk.E,pady=5,padx=5)
self.cv_integrator={'NVE':tk.IntVar(),'NVT':tk.IntVar(),'NPT':tk.IntVar()}
self.cv_integrator['NVE'].set(0)
self.cv_integrator['NVT'].set(0)
self.cv_integrator['NPT'].set(0)
self.cb_integrator_nve = tk.Checkbutton(self.control_md_frame, text='NVE', variable=self.cv_integrator['NVE'], onvalue = 1, offvalue = 0 , command=self._cb_integrator_nve)
self.cb_integrator_nve.grid(row=1,column=1,sticky=tk.W+tk.E,pady=5,padx=5)
self.cb_integrator_nvt = tk.Checkbutton(self.control_md_frame, text='NVT', variable=self.cv_integrator['NVT'], onvalue = 1, offvalue = 0 , command=self._cb_integrator_nvt)
self.cb_integrator_nvt.grid(row=1,column=2,sticky=tk.W+tk.E,pady=5,padx=5)
self.cb_integrator_npt = tk.Checkbutton(self.control_md_frame, text='NPT', variable=self.cv_integrator['NPT'], onvalue = 1, offvalue = 0 , command=self._cb_integrator_npt)
self.cb_integrator_npt.grid(row=1,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
#potential
lpot = tk.Label(self.control_md_frame, text="potential")
lpot.grid(row=2,column=0,sticky=tk.W+tk.E,pady=5,padx=5)
self.cv_pot={'LJ':tk.IntVar(),'Morse':tk.IntVar(),'RI':tk.IntVar(),'BMHFTD':tk.IntVar(),'PIM':tk.IntVar()}
self.cv_pot['LJ'].set(0)
self.cv_pot['Morse'].set(0)
self.cv_pot['RI'].set(0)
self.cv_pot['BMHFTD'].set(0)
self.cv_pot['PIM'].set(0)
self.cb_pot_lj = tk.Checkbutton(self.control_md_frame, text='Lennard-Jones', variable=self.cv_pot['LJ'], onvalue = 1, offvalue = 0 , command=self._cb_pot_lj)
self.cb_pot_lj.grid(row=2,column=1,sticky=tk.W+tk.E,pady=5,padx=5)
self.cb_pot_morse = tk.Checkbutton(self.control_md_frame, text='Morse', variable=self.cv_pot['Morse'], onvalue = 1, offvalue = 0 , command=self._cb_pot_morse)
self.cb_pot_morse.grid(row=2,column=2,sticky=tk.W+tk.E,pady=5,padx=5)
self.cb_pot_ri = tk.Checkbutton(self.control_md_frame, text='Rigid Ion', variable=self.cv_pot['RI'], onvalue = 1, offvalue = 0 , command=self._cb_pot_ri)
self.cb_pot_ri.grid(row=2,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.cb_pot_bmhftd = tk.Checkbutton(self.control_md_frame, text='BMHFTD', variable=self.cv_pot['BMHFTD'], onvalue = 1, offvalue = 0 , command=self._cb_pot_bmhftd)
self.cb_pot_bmhftd.grid(row=2,column=4,sticky=tk.W+tk.E,pady=5,padx=5)
self.cb_pot_pim = tk.Checkbutton(self.control_md_frame, text='PIM', variable=self.cv_pot['PIM'], onvalue = 1, offvalue = 0 , command=self._cb_pot_pim)
self.cb_pot_pim.grid(row=2,column=5,sticky=tk.W+tk.E,pady=5,padx=5)
gene=tk.Button(self.control_md_frame, text="Generate control file", command = lambda:self._gene_md(calc))
gene.grid(row=9,column=0,columnspan=5,sticky=tk.W+tk.E,pady=5)
self.nb.select(0) # show control tab
#----------------------------------------------------------------------
def _gene_md(self,calc):
filename='control_'+calc+'.F'
kintegration=None
kcontrol=None
kpotential=None
if self.cv_integrator['NVE'].get() == 1 :
kintegration='NVE'
if self.cv_integrator['NVT'].get() == 1 :
kintegration='NVT'
if self.cv_integrator['NPT'].get() == 1 :
kintegration='NPT'
if self.cv_pot['LJ'].get() == 1 :
kpotential = 'LJ'
kcontrol='LJ'
if self.cv_pot['Morse'].get() == 1 :
kpotential = 'Morse'
kcontrol='Morse'
if self.cv_pot['PIM'].get() == 1 :
kpotential = 'PIM'
kcontrol='PIM'
if self.cv_pot['RI'].get() == 1 :
kpotential = 'RI'
kcontrol='RI'
if self.cv_pot['BMHFTD'].get() == 1 :
kpotential = 'BMHFTD'
kcontrol='BMHFTD'
get_control_file(calc,self.control_values,kcontrol,self.md_values,kintegration,self.field_values,kpotential)
file = open(filename, 'rb')
if file != None:
content = file.read()
self.txt_control.delete('1.0','end')
self.txt_control.insert('1.0',content)
file.close()
self.nb.select(0) # show control tab
#----------------------------------------------------------------------
def _cb_pot_lj(self,event=None):
if self.cv_pot['LJ'].get() == 0:
self.cb_pot_morse.configure(state="normal")
self.cb_pot_ri.configure(state="normal")
self.cb_pot_pim.configure(state="normal")
self.cb_pot_bmhftd.configure(state="normal")
else:
self.cb_pot_morse.configure(state=tk.DISABLED)
self.cb_pot_ri.configure(state=tk.DISABLED)
self.cb_pot_pim.configure(state=tk.DISABLED)
self.cb_pot_bmhftd.configure(state=tk.DISABLED)
self.control_values['lnmlj'] = ".true."
self.control_values['lvnlist'] = ".true."
self.control_values['lreduced'] = ".true."
#----------------------------------------------------------------------
def _cb_pot_ri(self,event=None):
if self.cv_pot['RI'].get() == 0:
self.cb_pot_morse.configure(state="normal")
self.cb_pot_lj.configure(state="normal")
self.cb_pot_pim.configure(state="normal")
self.cb_pot_bmhftd.configure(state="normal")
else:
self.cb_pot_morse.configure(state=tk.DISABLED)
self.cb_pot_lj.configure(state=tk.DISABLED)
self.cb_pot_pim.configure(state=tk.DISABLED)
self.cb_pot_bmhftd.configure(state=tk.DISABLED)
self.field_values['lautoES'] = ".true."
self.control_values['lcoulomb'] = ".true."
self.control_values['lbmhftd'] = ".true."
self.control_values['lbmhft'] = ".true."
self.control_values['lreduced'] = ".true."
#----------------------------------------------------------------------
def _cb_pot_morse(self,event=None):
if self.cv_pot['Morse'].get() == 0:
self.cb_pot_lj.configure(state="normal")
self.cb_pot_ri.configure(state="normal")
self.cb_pot_pim.configure(state="normal")
self.cb_pot_bmhftd.configure(state="normal")
else:
self.cb_pot_lj.configure(state=tk.DISABLED)
self.cb_pot_ri.configure(state=tk.DISABLED)
self.cb_pot_pim.configure(state=tk.DISABLED)
self.cb_pot_bmhftd.configure(state=tk.DISABLED)
self.control_values['lmorse'] = ".true."
self.control_values['lvnlist'] = ".true."
self.control_values['lreduced'] = ".true."
#----------------------------------------------------------------------
def _cb_pot_pim(self,event=None):
if self.cv_pot['PIM'].get() == 0:
self.cb_pot_morse.configure(state="normal")
self.cb_pot_ri.configure(state="normal")
self.cb_pot_lj.configure(state="normal")
self.cb_pot_bmhftd.configure(state="normal")
else:
self.cb_pot_morse.configure(state=tk.DISABLED)
self.cb_pot_ri.configure(state=tk.DISABLED)
self.cb_pot_lj.configure(state=tk.DISABLED)
self.cb_pot_bmhftd.configure(state=tk.DISABLED)
self.field_values['lautoES'] = ".true."
self.control_values['lcoulomb'] = ".true."
self.control_values['lbmhftd'] = ".true."
self.control_values['lbmhft'] = ".true."
self.control_values['lreduced'] = ".true."
#----------------------------------------------------------------------
def _cb_pot_bmhftd(self,event=None):
if self.cv_pot['BMHFTD'].get() == 0:
self.cb_pot_morse.configure(state="normal")
self.cb_pot_ri.configure(state="normal")
self.cb_pot_pim.configure(state="normal")
self.cb_pot_lj.configure(state="normal")
else:
self.cb_pot_morse.configure(state=tk.DISABLED)
self.cb_pot_ri.configure(state=tk.DISABLED)
self.cb_pot_pim.configure(state=tk.DISABLED)
self.cb_pot_lj.configure(state=tk.DISABLED)
#----------------------------------------------------------------------
def _cb_integrator_nve(self,event=None):
if self.cv_integrator['NVE'].get() == 0:
self.cb_integrator_nvt.configure(state="normal")
self.cb_integrator_npt.configure(state="normal")
else:
self.cb_integrator_nvt.configure(state=tk.DISABLED)
self.cb_integrator_npt.configure(state=tk.DISABLED)
self.md_values['integrator'] = "'nve-vv'"
#----------------------------------------------------------------------
def _cb_integrator_nvt(self,event=None):
if self.cv_integrator['NVT'].get() == 0:
self.cb_integrator_nve.configure(state="normal")
self.cb_integrator_npt.configure(state="normal")
else:
self.cb_integrator_nve.configure(state=tk.DISABLED)
self.cb_integrator_npt.configure(state=tk.DISABLED)
self.md_values['integrator'] = "'nvt-nhcn'"
#----------------------------------------------------------------------
def _cb_integrator_npt(self,event=None):
if self.cv_integrator['NPT'].get() == 0:
self.cb_integrator_nve.configure(state="normal")
self.cb_integrator_nvt.configure(state="normal")
else:
self.cb_integrator_nve.configure(state=tk.DISABLED)
self.cb_integrator_nvt.configure(state=tk.DISABLED)
self.md_values['integrator'] = "'npt-nhcnp'"
#----------------------------------------------------------------------
def _create_posff_file(self):
# remove possible frame in the same region
if self.plot_frame is not None :
self.plot_frame.destroy()
if self.control_md_frame is not None :
self.control_md_frame.destroy()
self.config_frame = tk.Frame(self.parent, name='config_frame')
self.config_frame.pack(side=tk.LEFT,fill=tk.BOTH)
mainlabel = tk.Label(self.config_frame, text="Construct POSFF from scratch")
mainlabel.grid(row=0,column=0,columnspan=5,sticky=tk.W+tk.E,pady=5,padx=10)
self.config_frame.columnconfigure(0,weight=1)
self.config_frame.columnconfigure(1,weight=1)
self.config_frame.columnconfigure(2,weight=2)
self.config_frame.columnconfigure(3,weight=2)
self.config_frame.columnconfigure(4,weight=2)
# nions
lnions = tk.Label(self.config_frame, text="# ions")
lnions.grid(row=1,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.nions=tk.IntVar(None)
mnions=tk.Message(self.config_frame, textvariable=self.nions , justify=tk.LEFT, width=100)
mnions.grid(row=1,column=4,columnspan=2,sticky=tk.W+tk.E,pady=5,padx=5)
# atype
latype = tk.Label(self.config_frame, text="ion type")
latype.grid(row=2,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.atype=tk.StringVar(None)
eatype=tk.Entry(self.config_frame,textvariable=self.atype)
eatype.grid(row=2,column=4,columnspan=2,sticky=tk.W+tk.E,pady=5,padx=5)
# itype
litype = tk.Label(self.config_frame, text="nb per type")
litype.grid(row=3,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.itype=tk.IntVar(None)
eitype=tk.Entry(self.config_frame,textvariable=self.itype)
eitype.grid(row=3,column=4,columnspan=2,sticky=tk.W+tk.E,pady=5,padx=5)
# list box
self.lb_type = MultiListbox(self.config_frame,(('type', 10),('nb per type', 10)))
self.lb_type.grid(row=1,column=0,rowspan=4,columnspan=3,sticky=tk.W+tk.E,pady=5,padx=5)
add_button = tk.Button(self.config_frame, text="Add", command = self._add_ion_to_list)
add_button.grid(row=4,column=3,sticky=tk.W+tk.E,padx=10,pady=5)
delete_button = tk.Button(self.config_frame, text="Remove",command=lambda lb_type=self.lb_type: self.lb_type.delete(tk.ACTIVE))
delete_button.grid(row=4,column=4,sticky=tk.W+tk.E,pady=5,padx=10)
self.cv_cubic = tk.IntVar()
self.cv_ortho = tk.IntVar()
self.cv_tric = tk.IntVar()
self.cv_cubic.set(1)
self.cv_ortho.set(0)
self.cv_tric.set(0)
self.la = tk.Label(self.config_frame, text="a")
self.la.grid(row=6,column=1,sticky=tk.W+tk.E,pady=5,padx=5)
self.a1param=tk.StringVar(None)
self.a1param.set(0.00000000)
self.ea1=tk.Entry(self.config_frame,textvariable=self.a1param)
self.ea1.grid(row=6,column=2,sticky=tk.W+tk.E,pady=5,padx=5)
self.a2param=tk.StringVar(None)
self.a2param.set(0.00000000)
self.ea2=tk.Entry(self.config_frame,textvariable=self.a2param,state=tk.DISABLED)
self.ea2.grid(row=6,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.a3param=tk.StringVar(None)
self.a3param.set(0.00000000)
self.ea3=tk.Entry(self.config_frame,textvariable=self.a3param,state=tk.DISABLED)
self.ea3.grid(row=6,column=4,sticky=tk.W+tk.E,pady=5,padx=5)
self.lb = tk.Label(self.config_frame, text="b",state=tk.DISABLED)
self.lb.grid(row=7,column=1,sticky=tk.W+tk.E,pady=5,padx=5)
self.b1param=tk.StringVar(None)
self.b1param.set(0.00000000)
self.eb1=tk.Entry(self.config_frame,textvariable=self.b1param,state=tk.DISABLED)
self.eb1.grid(row=7,column=2,sticky=tk.W,pady=5,padx=5)
self.b2param=tk.StringVar(None)
self.b2param.set(0.00000000)
self.eb2=tk.Entry(self.config_frame,textvariable=self.b2param,state=tk.DISABLED)
self.eb2.grid(row=7,column=3,sticky=tk.W,pady=5,padx=5)
self.b3param=tk.StringVar(None)
self.b3param.set(0.00000000)
self.eb3=tk.Entry(self.config_frame,textvariable=self.b3param,state=tk.DISABLED)
self.eb3.grid(row=7,column=4,sticky=tk.W,pady=5,padx=5)
self.lc = tk.Label(self.config_frame, text="c",state=tk.DISABLED)
self.lc.grid(row=8,column=1,sticky=tk.W,pady=5,padx=5)
self.c1param=tk.StringVar(None)
self.c1param.set(0.00000000)
self.ec1=tk.Entry(self.config_frame,textvariable=self.c1param,state=tk.DISABLED)
self.ec1.grid(row=8,column=2,sticky=tk.W,pady=5,padx=5)
self.c2param=tk.StringVar(None)
self.c2param.set(0.00000000)
self.ec2=tk.Entry(self.config_frame,textvariable=self.c2param,state=tk.DISABLED)
self.ec2.grid(row=8,column=3,sticky=tk.W,pady=5,padx=5)
self.c3param=tk.StringVar(None)
self.c3param.set(0.00000000)
self.ec3=tk.Entry(self.config_frame,textvariable=self.c3param,state=tk.DISABLED)
self.ec3.grid(row=8,column=4,sticky=tk.W,pady=5,padx=5)
self.cb_cubic = tk.Checkbutton(self.config_frame, text = "cubic", variable = self.cv_cubic, onvalue = 1, offvalue = 0 , command=self._cb_cubic)
self.cb_cubic.grid(row=6,column=0,sticky=tk.W,pady=5)
self.cb_ortho = tk.Checkbutton(self.config_frame, text = "ortorhombic", variable = self.cv_ortho, onvalue = 1, offvalue = 0 , command=self._cb_ortho,state=tk.DISABLED)
self.cb_ortho.grid(row=7,column=0,sticky=tk.W,pady=5)
self.cb_tric = tk.Checkbutton(self.config_frame, text = "triclinic", variable = self.cv_tric, onvalue = 1, offvalue = 0 , command=self._cb_tric,state=tk.DISABLED)
self.cb_tric.grid(row=8,column=0,sticky=tk.W,pady=5)
gene=tk.Button(self.config_frame, text="Generate random config", command = self._gene)
gene.grid(row=9,column=0,columnspan=5,sticky=tk.W+tk.E,pady=5)
filename='POSFF_'
#----------------------------------------------------------------------
def _gene(self):
atype=[]
itype=[]
for l in self.lb_type.get(0,tk.END):
atype.append(l[0])
itype.append(l[1])
if self.cv_cubic.get() == 1:
u =[ float(self.a1param.get()), 0.0 , 0.0 ]
v =[ 0.0 , float(self.a1param.get()), 0.0 ]
w =[ 0.0 , 0.0 , float(self.a1param.get()) ]
if self.cv_ortho.get() == 1:
u =[ float(self.a1param.get()), 0.0 , 0.0 ]
v =[ 0.0 , float(self.b1param.get()), 0.0 ]
w =[ 0.0 , 0.0 , float(self.c1param.get()) ]
elif self.cv_tric.get() == 1:
u =[ float(self.a1param.get()) , float(self.a2param.get()) ,float(self.a3param.get()) ]
v =[ float(self.b1param.get()) , float(self.b2param.get()) ,float(self.b3param.get()) ]
w =[ float(self.c1param.get()) , float(self.c2param.get()) ,float(self.c3param.get()) ]
ions=[]
conf = Config(ions=ions,u=u,v=v,w=w,system='randomPY',natm=self.nions.get(),ntype=len(atype),types=atype, natmpertype = itype, coord_format='Direct')
for ia in range(conf.natm):
conf.ions.append ( Ion ( index_ion=ia ) )
conf.typeinfo_init()
# random structure in the box
for ia in range(conf.natm):
x = random.random()
y = random.random()
z = random.random()
conf.move(ia,pos=[x,y,z])
conf.write_POSFF('POSFF.randomPY')
file = open('POSFF.randomPY', 'rb')
if file != None:
content = file.read()
self.txt_posff.delete('1.0','end')
self.txt_posff.insert('1.0',content)
file.close()
self.nb.select(1) # show tab 1 == posff
#----------------------------------------------------------------------
def _cb_cubic(self,event=None):
if self.cv_cubic.get() == 0:
self.cb_ortho.configure(state="normal")
self.cb_tric.configure(state="normal")
self.la.configure(state=tk.DISABLED)
self.lb.configure(state=tk.DISABLED)
self.lc.configure(state=tk.DISABLED)
self.ea1.configure(state=tk.DISABLED)
self.ea2.configure(state=tk.DISABLED)
self.ea3.configure(state=tk.DISABLED)
self.eb1.configure(state=tk.DISABLED)
self.eb2.configure(state=tk.DISABLED)
self.eb3.configure(state=tk.DISABLED)
self.ec1.configure(state=tk.DISABLED)
self.ec2.configure(state=tk.DISABLED)
self.ec3.configure(state=tk.DISABLED)
else:
self.cb_ortho.configure(state=tk.DISABLED)
self.cb_tric.configure(state=tk.DISABLED)
self.la.configure(state="normal")
self.lb.configure(state=tk.DISABLED)
self.lc.configure(state=tk.DISABLED)
self.ea1.configure(state="normal")
self.ea2.configure(state=tk.DISABLED)
self.ea3.configure(state=tk.DISABLED)
self.eb1.configure(state=tk.DISABLED)
self.eb2.configure(state=tk.DISABLED)
self.eb3.configure(state=tk.DISABLED)
self.ec1.configure(state=tk.DISABLED)
self.ec2.configure(state=tk.DISABLED)
self.ec3.configure(state=tk.DISABLED)
#----------------------------------------------------------------------
def _cb_ortho(self,event=None):
if self.cv_ortho.get() == 0:
self.cb_cubic.configure(state="normal")
self.cb_tric.configure(state="normal")
self.la.configure(state=tk.DISABLED)
self.lb.configure(state=tk.DISABLED)
self.lc.configure(state=tk.DISABLED)
self.ea1.configure(state=tk.DISABLED)
self.ea2.configure(state=tk.DISABLED)
self.ea3.configure(state=tk.DISABLED)
self.eb1.configure(state=tk.DISABLED)
self.eb2.configure(state=tk.DISABLED)
self.eb3.configure(state=tk.DISABLED)
self.ec1.configure(state=tk.DISABLED)
self.ec2.configure(state=tk.DISABLED)
self.ec3.configure(state=tk.DISABLED)
else:
self.cb_cubic.configure(state=tk.DISABLED)
self.cb_tric.configure(state=tk.DISABLED)
self.la.configure(state="normal")
self.lb.configure(state="normal")
self.lc.configure(state="normal")
self.ea1.configure(state="normal")
self.ea2.configure(state=tk.DISABLED)
self.ea3.configure(state=tk.DISABLED)
self.eb1.configure(state="normal")
self.eb2.configure(state=tk.DISABLED)
self.eb3.configure(state=tk.DISABLED)
self.ec1.configure(state="normal")
self.ec2.configure(state=tk.DISABLED)
self.ec3.configure(state=tk.DISABLED)
#----------------------------------------------------------------------
def _cb_tric(self,event=None):
if self.cv_tric.get() == 0:
self.cb_ortho.configure(state="normal")
self.cb_cubic.configure(state="normal")
self.la.configure(state=tk.DISABLED)
self.lb.configure(state=tk.DISABLED)
self.lc.configure(state=tk.DISABLED)
self.ea1.configure(state=tk.DISABLED)
self.ea2.configure(state=tk.DISABLED)
self.ea3.configure(state=tk.DISABLED)
self.eb1.configure(state=tk.DISABLED)
self.eb2.configure(state=tk.DISABLED)
self.eb3.configure(state=tk.DISABLED)
self.ec1.configure(state=tk.DISABLED)
self.ec2.configure(state=tk.DISABLED)
self.ec3.configure(state=tk.DISABLED)
else:
self.cb_cubic.configure(state=tk.DISABLED)
self.cb_ortho.configure(state=tk.DISABLED)
self.la.configure(state="normal")
self.lb.configure(state="normal")
self.lc.configure(state="normal")
self.ea1.configure(state="normal")
self.ea2.configure(state="normal")
self.ea3.configure(state="normal")
self.eb1.configure(state="normal")
self.eb2.configure(state="normal")
self.eb3.configure(state="normal")
self.ec1.configure(state="normal")
self.ec2.configure(state="normal")
self.ec3.configure(state="normal")
#----------------------------------------------------------------------
def _add_ion_to_list(self):
if self.atype.get() != "" and self.itype.get() != 0:
print "adding type",self.atype.get(),self.itype.get()
self.lb_type.insert (tk.END, (self.atype.get(),self.itype.get()))
self.nions.set(0)
for l in self.lb_type.get(0,tk.END):
self.nions.set(self.nions.get()+l[1])
print "current number of total ions ",self.nions.get()
#----------------------------------------------------------------------
def _apropos(self):
apropos = tk.Toplevel()
apropos.resizable(width=tk.FALSE, height=tk.FALSE)
apropos.title("About MDff")
about_message="""
MDFF parallel Molecular Dynamics ... For Fun
Copyright (C) 2011 F. Vasconcelos
This program is free software; you can redistribute it and/or
modify it under the terms of the GNU General Public License
as published by the Free Software Foundation; either version 2
of the License, or (at your option) any later version.
This program is distributed in the hope that it will be useful,
but WITHOUT ANY WARRANTY; without even the implied warranty of
MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the
GNU General Public License for more details.
You should have received a copy of the GNU General Public License
along with this program; if not, WRITE to the Free Software
Foundation, Inc., 51 Franklin Street, Fifth Floor, Boston, MA
02110-1301, USA.
"""
msg = tk.Message(apropos, text=about_message , justify=tk.LEFT, relief=tk.RAISED,width=2000)
msg.pack()
#----------------------------------------------------------------------
def _doc(self):
pdf_file_path = self.doc_path + '/' + 'mdff.pdf'
sys_pltfrm = platform.system()
print sys_pltfrm
cmd = { 'Linux' :'xpdf '}
try:
subprocess.call([cmd[sys_pltfrm] + pdf_file_path], shell=True)
except OSError as err:
sys.exit('Error opening pdf:\n\t{}'.format(err))
#----------------------------------------------------------------------
def _save_as(self):
if self.nb.tab(self.nb.select(), "text") == "control.F" :
name = tkFileDialog.asksaveasfile(mode='w',filetypes=[('control files','.F'),('all files','.*')])
text2save=str(self.txt_control.get(0.0,tk.END))
name.write(text2save)
name.close
elif self.nb.tab(self.nb.select(), "text") == "POSFF":
name = tkFileDialog.asksaveasfile(mode='w',filetypes=[('POSFF','POSFF* CONTFF*'),('all files','.*')])
text2save=str(self.txt_posff.get(0.0,tk.END))
name.write(text2save)
name.close
elif self.nb.tab(self.nb.select(), "text") == "log":
name = tkFileDialog.asksaveasfile(mode='w',filetypes=[('all files','.*')])
text2save=str(self.txt_stdout.get(0.0,tk.END))
name.write(text2save)
name.close
#----------------------------------------------------------------------
def _select_control_file(self):
self.control_path.set(tkFileDialog.askopenfilename(title="Select MDff control file",filetypes=[('control files','.F'),('all files','.*')]))
file = open(self.control_path.get(), 'a+')
if file != None:
content = file.read()
self.txt_control.delete('1.0','end')
self.txt_control.insert('1.0',content)
file.close()
self.txt_control.update()
self.nb.select(0) # show control tab
#----------------------------------------------------------------------
def _select_posff_file(self):
self.posff_path.set(tkFileDialog.askopenfilename(title="Select MDff POSFF file",filetypes=[('POSFF files','POSFF* CONTFF*'),('all files','*')]))
file = open(self.posff_path.get(), 'a+')
if file != None:
content = file.read()
self.txt_posff.delete('1.0','end')
self.txt_posff.insert('1.0',content)
file.close()
self.nb.select(1) # show posff tab
#----------------------------------------------------------------------
def _select_exe(self):
self.exe_path.set(tkFileDialog.askopenfilename(title="Select MDff executable",filetypes=[('exe files','.x'),('all files','.*')]))
#----------------------------------------------------------------------
def start_exe(self,event):
self._start_exe()
#----------------------------------------------------------------------
def _start_exe(self):
os.system("cp "+self.posff_path.get()+" POSFF")
self.nb.select(2) # show log tab
self.proc = subprocess.Popen('mpirun '+self.exe_path.get()+' '+self.control_path.get(), stdout=subprocess.PIPE ,shell=True, preexec_fn=os.setsid)
while True:
line = self.proc.stdout.readline()
if line != '':
l = line.rstrip()
self.txt_stdout.insert(tk.END, l+"\n")
self.txt_stdout.see(tk.END)
self.txt_stdout.update()
else:
break
#----------------------------------------------------------------------
def _kill_exe(self,event):
os.killpg(os.getpgid(self.proc.pid), signal.SIGTERM)
#----------------------------------------------------------------------
def _quit(self,event):
sys.exit(0)
#----------------------------------------------------------------------
def _save(self,event):
if self.nb.tab(self.nb.select(), "text") == "control.F" :
if os.path.isfile(self.control_path.get()) :
file_ = open(self.control_path.get(),'w')
text2save=str(self.txt_control.get(0.0,tk.END))
file_.write(text2save)
file_.close
else:
self._save_as()
elif self.nb.tab(self.nb.select(), "text") == "POSFF":
if os.path.isfile(self.posff_path.get()) :
file_ = open(self.posff_path,'w')
text2save=str(self.txt_posff.get(0.0,tk.END))
file_.write(text2save)
file_.close
else:
self._save_as()
elif self.nb.tab(self.nb.select(), "text") == "log":
if os.path.isfile(self.stdout_path.get()) :
file_ = open(self.stdout_path.get(),'w')
text2save=str(self.txt_stdout.get(0.0,tk.END))
file_.write(text2save)
file_.close
else:
self._save_as()
#----------------------------------------------------------------------
def _run_stat(self):
self.tstat = tk.Toplevel()
self.tstat.title("How many points ?")
lstat = tk.Label(self.tstat,text="#points ? (all)")
lstat.grid(row=0,column=0)
self.last_points=tk.StringVar(None)
estat = tk.Entry(self.tstat,textvariable=self.last_points)
estat.grid(row=1,column=0)
#estat.bind("<Return>",self._kill_window())
self.tstat.wait_window()
self._run_poszi()
#----------------------------------------------------------------------
def _kill_window(self):
print "inside _kill_window"
self.tstat.quit()
#----------------------------------------------------------------------
def _run_poszi(self):
filename='OSZIFF'
if not os.path.isfile('OSZIFF') :
tkMessageBox.showinfo("File missing", "OSZIFF file is missing for analysis")
return
if format_filename(filename):
self.name_quant,self.alldata = read_OSZIFF(filename)
else:
raise ValueError('Format of input file doesnt match OSZIFF')
if self.last_points.get() == 'all' or self.last_points.get() == '' :
lp = len(self.alldata[0])
else:
lp = int( self.last_points.get() )
print lp,self.last_points.get()
self.average,self.ainfo=averaging(self.name_quant,self.alldata,lp)
self._create_plot()
self._average_info()
#----------------------------------------------------------------------
def _new_plot(self,lp):
self.f=Figure()
self.a = self.f.add_subplot(111)
q=[2,12]
title='Total Energy MD'
t = self.alldata[1][-lp:]
s = self.alldata[q[0]][-lp:]
x1= [self.average[q[0]]]*len(t)
self.a.plot(t, s,'b')
self.a.plot(t, x1, '--' , color='b')
s = self.alldata[q[1]][-lp:]
x1= [self.average[q[1]]]*len(t)
self.a.plot(t, s , 'g')
self.a.plot(t, x1, '--', color='g')
self.a.set_xlabel(self.name_quant[1]+units[self.name_quant[1]])
self.a.set_ylabel(self.name_quant[q[0]]+units[self.name_quant[q[0]]])
self.a.set_title(title)
#----------------------------------------------------------------------
def _update_plot(self,delta,lp):
self.a.clear()
self.k+=delta
if self.k > 3 :
self.k = 3
return
if self.k < 0 :
self.k = 0
return
self.a.clear()
titles=['Total Energy MD','Potential Energy MD','Temperature MD','Volume MD']
qs=[2,4,7,11]
q=qs[self.k]
title=titles[self.k]
t = self.alldata[1][-lp:]
s = self.alldata[q][-lp:]
x1= [self.average[q]]*len(t)
self.a.plot(t, s,'b')
self.a.plot(t, x1, '--' , color='b')
if self.k == 0 :
s = self.alldata[12][-lp:]
x1= [self.average[12]]*len(t)
self.a.plot(t, s , 'g')
self.a.set_xlabel(self.name_quant[1]+units[self.name_quant[1]])
self.a.set_ylabel(self.name_quant[q]+units[self.name_quant[q]])
self.a.set_title(title)
self.canvas.draw()
#----------------------------------------------------------------------
def _create_plot(self):
if self.config_frame is not None :
self.config_frame.destroy()
if self.control_md_frame is not None :
self.control_md_frame.destroy()
self.plot_frame = tk.Frame(self.parent, name='plot_frame')
self.plot_frame.pack(side=tk.LEFT,fill=tk.Y)
if self.last_points.get() == 'all' or self.last_points.get() == '' :
lp = len(self.alldata[0])
else:
lp = int( self.last_points.get() )
self._new_plot(lp)
self.canvas = FigureCanvasTkAgg(self.f, self.plot_frame)
self.canvas.draw()
self.canvas.show()
self.canvas.get_tk_widget().pack(side=tk.TOP,fill=tk.X)
toolbar = NavigationToolbar2TkAgg(self.canvas, self.plot_frame)
toolbar.update()
self.canvas._tkcanvas.pack(side=tk.TOP,fill=tk.X)
self.k=0
previous_button = tk.Button(self.plot_frame, text="Previous Plot", command = lambda : self._update_plot(-1,lp),width=10)
next_button = tk.Button(self.plot_frame, text="Next Plot", command = lambda : self._update_plot(1,lp),width=10)
previous_button.pack(side=tk.LEFT)
next_button.pack(side=tk.LEFT)
#----------------------------------------------------------------------
def _average_info(self):
ainfo = tk.Toplevel()
ainfo.title("Run statistics")
ainfo.geometry('%dx%d+%d+%d' % (700, 320, 0, 0) )
ainfo.update()
ainfo_message='\n'
ainfo_message=str(len(self.alldata[0]))+" points in input file\n"
ainfo_message+="averaging on last "+str(self.last_points.get())+" points\n"
ainfo_message+='\n'
for l in self.ainfo:
ll='{0:<14} {1:<10} {2:15.8e} {3:^10} {4:15.8e} \n'.format("<"+l[0]+">","=",l[1],"std.",l[2])
ll.ljust(70)
ainfo_message+=ll
font = tkFont.Font(family="Courier", size=11,weight='bold')
msg = tk.Message(ainfo, text=ainfo_message , anchor='center',width=1000,font=font)
msg.pack(expand=True, fill='x',padx=10,pady=20)
msg.bind("<Configure>", lambda e: msg.configure(width=e.width-10))
#----------------------------------------------------------------------
def _nothing(self):
pass
def _create_posff_file(self):
# remove possible frame in the same region
if self.plot_frame is not None :
self.plot_frame.destroy()
if self.control_md_frame is not None :
self.control_md_frame.destroy()
self.config_frame = tk.Frame(self.parent, name='config_frame')
self.config_frame.pack(side=tk.LEFT,fill=tk.BOTH)
mainlabel = tk.Label(self.config_frame, text="Construct POSFF from scratch")
mainlabel.grid(row=0,column=0,columnspan=5,sticky=tk.W+tk.E,pady=5,padx=10)
self.config_frame.columnconfigure(0,weight=1)
self.config_frame.columnconfigure(1,weight=1)
self.config_frame.columnconfigure(2,weight=2)
self.config_frame.columnconfigure(3,weight=2)
self.config_frame.columnconfigure(4,weight=2)
# nions
lnions = tk.Label(self.config_frame, text="# ions")
lnions.grid(row=1,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.nions=tk.IntVar(None)
mnions=tk.Message(self.config_frame, textvariable=self.nions , justify=tk.LEFT, width=100)
mnions.grid(row=1,column=4,columnspan=2,sticky=tk.W+tk.E,pady=5,padx=5)
# atype
latype = tk.Label(self.config_frame, text="ion type")
latype.grid(row=2,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.atype=tk.StringVar(None)
eatype=tk.Entry(self.config_frame,textvariable=self.atype)
eatype.grid(row=2,column=4,columnspan=2,sticky=tk.W+tk.E,pady=5,padx=5)
# itype
litype = tk.Label(self.config_frame, text="nb per type")
litype.grid(row=3,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.itype=tk.IntVar(None)
eitype=tk.Entry(self.config_frame,textvariable=self.itype)
eitype.grid(row=3,column=4,columnspan=2,sticky=tk.W+tk.E,pady=5,padx=5)
# list box
self.lb_type = MultiListbox(self.config_frame,(('type', 10),('nb per type', 10)))
self.lb_type.grid(row=1,column=0,rowspan=4,columnspan=3,sticky=tk.W+tk.E,pady=5,padx=5)
add_button = tk.Button(self.config_frame, text="Add", command = self._add_ion_to_list)
add_button.grid(row=4,column=3,sticky=tk.W+tk.E,padx=10,pady=5)
delete_button = tk.Button(self.config_frame, text="Remove",command=lambda lb_type=self.lb_type: self.lb_type.delete(tk.ACTIVE))
delete_button.grid(row=4,column=4,sticky=tk.W+tk.E,pady=5,padx=10)
self.cv_cubic = tk.IntVar()
self.cv_ortho = tk.IntVar()
self.cv_tric = tk.IntVar()
self.cv_cubic.set(1)
self.cv_ortho.set(0)
self.cv_tric.set(0)
self.la = tk.Label(self.config_frame, text="a")
self.la.grid(row=6,column=1,sticky=tk.W+tk.E,pady=5,padx=5)
self.a1param=tk.StringVar(None)
self.a1param.set(0.00000000)
self.ea1=tk.Entry(self.config_frame,textvariable=self.a1param)
self.ea1.grid(row=6,column=2,sticky=tk.W+tk.E,pady=5,padx=5)
self.a2param=tk.StringVar(None)
self.a2param.set(0.00000000)
self.ea2=tk.Entry(self.config_frame,textvariable=self.a2param,state=tk.DISABLED)
self.ea2.grid(row=6,column=3,sticky=tk.W+tk.E,pady=5,padx=5)
self.a3param=tk.StringVar(None)
self.a3param.set(0.00000000)
self.ea3=tk.Entry(self.config_frame,textvariable=self.a3param,state=tk.DISABLED)
self.ea3.grid(row=6,column=4,sticky=tk.W+tk.E,pady=5,padx=5)
self.lb = tk.Label(self.config_frame, text="b",state=tk.DISABLED)
self.lb.grid(row=7,column=1,sticky=tk.W+tk.E,pady=5,padx=5)
self.b1param=tk.StringVar(None)
self.b1param.set(0.00000000)
self.eb1=tk.Entry(self.config_frame,textvariable=self.b1param,state=tk.DISABLED)
self.eb1.grid(row=7,column=2,sticky=tk.W,pady=5,padx=5)
self.b2param=tk.StringVar(None)
self.b2param.set(0.00000000)
self.eb2=tk.Entry(self.config_frame,textvariable=self.b2param,state=tk.DISABLED)
self.eb2.grid(row=7,column=3,sticky=tk.W,pady=5,padx=5)
self.b3param=tk.StringVar(None)
self.b3param.set(0.00000000)
self.eb3=tk.Entry(self.config_frame,textvariable=self.b3param,state=tk.DISABLED)
self.eb3.grid(row=7,column=4,sticky=tk.W,pady=5,padx=5)
self.lc = tk.Label(self.config_frame, text="c",state=tk.DISABLED)
self.lc.grid(row=8,column=1,sticky=tk.W,pady=5,padx=5)
self.c1param=tk.StringVar(None)
self.c1param.set(0.00000000)
self.ec1=tk.Entry(self.config_frame,textvariable=self.c1param,state=tk.DISABLED)
self.ec1.grid(row=8,column=2,sticky=tk.W,pady=5,padx=5)
self.c2param=tk.StringVar(None)
self.c2param.set(0.00000000)
self.ec2=tk.Entry(self.config_frame,textvariable=self.c2param,state=tk.DISABLED)
self.ec2.grid(row=8,column=3,sticky=tk.W,pady=5,padx=5)
self.c3param=tk.StringVar(None)
self.c3param.set(0.00000000)
self.ec3=tk.Entry(self.config_frame,textvariable=self.c3param,state=tk.DISABLED)
self.ec3.grid(row=8,column=4,sticky=tk.W,pady=5,padx=5)
self.cb_cubic = tk.Checkbutton(self.config_frame, text = "cubic", variable = self.cv_cubic, onvalue = 1, offvalue = 0 , command=self._cb_cubic)
self.cb_cubic.grid(row=6,column=0,sticky=tk.W,pady=5)
self.cb_ortho = tk.Checkbutton(self.config_frame, text = "ortorhombic", variable = self.cv_ortho, onvalue = 1, offvalue = 0 , command=self._cb_ortho,state=tk.DISABLED)
self.cb_ortho.grid(row=7,column=0,sticky=tk.W,pady=5)
self.cb_tric = tk.Checkbutton(self.config_frame, text = "triclinic", variable = self.cv_tric, onvalue = 1, offvalue = 0 , command=self._cb_tric,state=tk.DISABLED)
self.cb_tric.grid(row=8,column=0,sticky=tk.W,pady=5)
gene=tk.Button(self.config_frame, text="Generate random config", command = self._gene)
gene.grid(row=9,column=0,columnspan=5,sticky=tk.W+tk.E,pady=5)
filename='POSFF_'
def create_mutilistbox(self, mutilistbox_items):
self.people_mutilistbox = MultiListbox(self, mutilistbox_items)
self.people_mutilistbox['width'] = 200
self.people_mutilistbox['height'] = 100
self.refresh_mutilistbox()
class EmailSettings(Toplevel):
def __init__(self, parent):
Toplevel.__init__(self, parent, height=400, width=700)
#self.pack_propagate(0)
self.transient(parent)
self.title("VSAS - Email Settings")
self._parent = parent
self.adminEmail = ""
emailFile = open("emailTester.txt", "r")
self.emailList = emailFile.readlines()
emailFile.close()
body = Frame(self, bg="black")
self._initialFocus = self.body(body)
body.pack_propagate(0)
body.pack(padx=5, pady=5)
self.buttonBox()
self.current = None
self.grab_set()
self.bind("<F1>", self.displayHelp)
if not self._initialFocus:
self._initialFocus = self
self.protocol("WM_DELETE_WINDOW", self.cancel)
self.geometry("+%d+%d" %
(parent.winfo_rootx() + 50, parent.winfo_rooty() + 50))
self._initialFocus.focus_set()
self._parent.wait_window(self)
def body(self, master):
# create canvas to hold scrollbar and listbox objects
emailListCanvas = Canvas(master, width=350, height=400)
emailListCanvas.config(scrollregion=emailListCanvas.bbox(ALL))
emailListCanvas.grid(column=0, sticky=W)
# create multiListbox to hold email list
self._emailListbox = MultiListbox(emailListCanvas,
(('Email', 160), ("", 1)),
command=self.deleteEmail)
for item in self.emailList:
self._emailListbox.insert(END, (item, ""))
self._emailListbox.grid(column=0, columnspan=3, sticky=W)
addButton = Button(emailListCanvas, text="Add", command=self.addEmail)
addButton.grid(row=1, column=0)
deleteButton = Button(emailListCanvas,
text="Delete",
command=self.deleteEmail)
deleteButton.grid(row=1, column=1)
helpButton = Button(emailListCanvas,
text="Help",
command=self.displayHelp)
helpButton.grid(row=1, column=2)
#Label(master, text="The administrator email will receive\nall information regarding all alerts",
#fg="green",bg="black").grid(column=1, row=0)
#self.adminEmailDisplay = Label(master, text=self.adminEmail)
#self.adminEmailDisplay.grid(column=1, row=1)
def buttonBox(self):
pass
def addEmail(self):
email = EmailInput(self, title="Add Email").get()
if len(email) > 0:
emailFile = open("emailTester.txt", "a")
#emailComposite = email.split(",")
#emailTuple = (emailComposite[0], emailComposite[1])
print email
email = email + "\n"
self.emailList.append(email)
emailFile.write(email)
emailFile.close()
self._emailListbox.insert(END, (email, ""))
self.update()
def deleteEmail(self, event=None):
if MsgBox.askyesno("Delete Email?",
"Are you sure you want to delete selected email?"):
index = self.emailList[eval(self._emailListbox.curselection()[0])]
self.emailList.remove(index)
self._emailListbox.delete(0, END)
emailFile = open("emailTester.txt", "w")
for item in self.emailList:
emailFile.write(item)
self._emailListbox.insert(END, (item, ""))
emailFile.close()
def displayHelp(self, event=None):
helpText = open("EmailScreenHelp.txt", "r").read()
MsgBox.showinfo(title="VSAS Email Settings - Help", message=helpText)
def cancel(self, event=None):
if MsgBox.askyesno(
"Done?", "All changes have been saved.\nReturn to VSAS Main?"):
self._parent.focus_set()
self.destroy()