/
run.py
80 lines (63 loc) · 2.26 KB
/
run.py
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from PyQt4 import QtCore, QtGui
from ui import Ui_Dialog
import string
import os, sys
class Apptt(QtGui.QMainWindow):
def __init__(self,parent=None):
QtGui.QWidget.__init__(self,parent)
self.loginGui()
def loginGui(self):
self.ui = Ui_Dialog()
self.ui.setupUi(self)
self.ui.Tbl_GPCR.setRowCount(100)
self.ui.Tbl_GPCR.setItem(0, 0, QtGui.QTableWidgetItem(""));
self.show()
@QtCore.pyqtSlot(int)
def browsefile(self):
self.ui.Ln_Filename.setText(QtGui.QFileDialog.getOpenFileName(self, "open file", " ", "PDB file(*.pdb);;Allfile(*.*)" ))
file = open(self.ui.Ln_Filename.text())
title=""
author=""
num=0
while True:
line=file.readline()
if not line:
break
if line.find("AUTHOR")!=-1:
line=line.strip()
print line
author=author+line[10:]
self.ui.Tbl_GPCR.setItem(0, 3, QtGui.QTableWidgetItem(line));
if line.find("HEADER")!=-1:
num=line.index("-")
self.ui.Tbl_GPCR.setItem(0, 4, QtGui.QTableWidgetItem(line[num-2:num+7]));
if line[0:5]=="TITLE":
line=line.strip()
title=title+line[10:]
self.ui.Tbl_GPCR.setItem(0, 1, QtGui.QTableWidgetItem(title));
if line[12:15]=="REF":
line=line.strip()
jounal=jounal+line[19:]
self.ui.Tbl_GPCR.setItem(0, 2, QtGui.QTableWidgetItem(jounal));
if line[0:6]=="EXPDTA":
line=line.strip()
method=method+line[10:]
self.ui.Tbl_GPCR.setItem(0, 8, QtGui.QTableWidgetItem(method));
if line[11:22]=="RESOLUTION.":
line=line.strip()
resolution=resolution+line[26:]
self.ui.Tbl_GPCR.setItem(0, 9, QtGui.QTableWidgetItem(resolution));
if line[13:47]=="R VALUE (WORKING + TEST SET) :":
line=line.strip()
r_value=r_value+line[48:]
self.ui.Tbl_GPCR.setItem(0, 10, QtGui.QTableWidgetItem(r_value));
if line[13:26]=="PROTEIN ATOMS":
line=line.strip()
protein_num=protein_num+line[40:]
self.ui.Tbl_GPCR.setItem(0, 1, QtGui.QTableWidgetItem(protein_num));
@QtCore.pyqtSlot(int)
def submitdata(self):
self.ui.Ln_Filename.setText(QtGui.QFileDialog.getOpenFileName(self, "open file", " ", "PDB file(*.pdb);;Allfile(*.*)" ))
app = QtGui.QApplication(sys.argv)
myqq = Apptt()
sys.exit(app.exec_())