def on_getgroup_button_clicked_handler(self, *arg):
# print "sel",selection().encodeSimple()
s = self.getStructure()
sel = selection()
if s is None:
self.group_entry.set_text(sel.encodeSimple())
self.setFrom(None)
else:
self.group_entry.set_text(sel.encode(s))
self.setFrom(first(s, sel))
def initUI(self):
self.view_box=self.xml.get_widget("view_box")
self.model=DistanceTreeModel(self.getCurrentStructure(),selection())
self.treeview,self.treeviewscrolled=self.make_treeview(self.model,self.xml.get_widget("treeview"))
self.view_box.add(self.treeviewscrolled)
self.zmat_button=self.xml.get_widget("zmat_button")
self.dist_button=self.xml.get_widget("dist_button")
self.structureopt=self.xml.get_widget("structureopt")
if self.zmat_button.get_active():
self.showtype=self.ZMAT_TYPE
if self.dist_button.get_active():
self.showtype=self.DIST_TYPE
self.updateSystem()
def on_tocms_button_clicked_handler(self, *arg):
self.setTo(cms(self.getStructure(), selection()))
self.updateV()
def on_toavg_button_clicked_handler(self, *arg):
self.setTo(average(self.getStructure(), selection()))
self.updateV()
def updateSystem(self,x=None):
self.sel=selection()
self.updateCoord()
self.updateLabels()
def updateTable(self,x=None):
if self.showtype==self.DIST_TYPE:
self.showDistances(self.getCurrentStructure(),selection())
else:
self.showZMat(self.getCurrentStructure(),selection())
