Exemplo n.º 1
0
 def analysepKas(self, p=None):
     """Get the main pKas of all/titr group and do analysis"""
     E = self.currprj
     if E==None: return
     t = TitrationAnalyser()
     if p == None:
         p = t.findpKas(E, titratable=True, reliable=False, minspan=0.06)
     t.analysepKas(p)
     return