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exception in _buildInputLig ERROR ********************************************* Traceback (most recent call last): File "E:\Drug Design\lib\site-packages\ViewerFramework\VF.py", line 898, in tryto result = command( *args, **kw ) File "E:\Drug Design\lib\site-packages\AutoDockTools\autoanalyzeCommands.py", line 3852, in doit d.readDlg(dlgFile) File "E:\Drug Design\lib\site-packages\AutoDockTools\Docking.py", line 105, in readDlg self.ch = ConformationHandler(self.ligMol, AttributeError: Docking instance has no attribute 'ligMol' Exception in Tkinter callback Traceback (most recent call last): File "E:\Drug Design\lib\lib-tk\Tkinter.py", line 1403, in __call__ return self.func(*args) File "E:\Drug Design\lib\site-packages\AutoDockTools\autoanalyzeCommands.py", line 3208, in guiCallback if hasattr(d.ligMol, 'vina_energy'): AttributeError: Docking instance has no attribute 'ligMol' exception in _buildInputLig ERROR ********************************************* Traceback (most recent call last): File "E:\Drug Design\lib\site-packages\ViewerFramework\VF.py", line 898, in tryto result = command( *args, **kw ) File "E:\Drug Design\lib\site-packages\AutoDockTools\autoanalyzeCommands.py", line 3852, in doit d.readDlg(dlgFile) File "E:\Drug Design\lib\site-packages\AutoDockTools\Docking.py", line 105, in readDlg self.ch = ConformationHandler(self.ligMol, AttributeError: Docking instance has no attribute 'ligMol' exception in _buildInputLig ERROR ********************************************* Traceback (most recent call last): File "E:\Drug Design\lib\site-packages\ViewerFramework\VF.py", line 898, in tryto result = command( *args, **kw ) File "E:\Drug Design\lib\site-packages\AutoDockTools\autoanalyzeCommands.py", line 3852, in doit d.readDlg(dlgFile) File "E:\Drug Design\lib\site-packages\AutoDockTools\Docking.py", line 105, in readDlg self.ch = ConformationHandler(self.ligMol, AttributeError: Docking instance has no attribute 'ligMol' Èí¼þ×°µÄÓ¦¸ÃûÓÐÎÊÌâ.....Ò»Ö±´íŪ²»³öÀ´¡£¡£¡£¡£µ°ÌÛ¡£¡£¡£Çó´óÉñ½â¾ÈÖС£¡£¡£¡£ лл£¡ ÅäÌåºÍÊÜÌå×¼±¸ºÃºó£¬µ÷ÕûÍêgrid£¬µ½ÔËÐÐautogrid,ʱ¼äºÜ¶Ì¡£¡£¡£Ò»ÉÁ¾ÍÍêÁË£¬Ã»¼ûÌáʾsuccess....È»ºódocking,ʱ¼äºÜÒ»ÉÁ¾ÍÍíÁË¡£¡£Ò»Ö±ÕâÑù¡£¡£°¦£¬²»ÖªµÀÄÄÀïÓÐÎÊÌâ¡£¡£ |
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