阿里大神,前辈您好,感谢您能在百忙之中看到我的留言!
小弟在用autodock软件时,一直无法生成gpf文件,导致autogrid运行时总不成功,并且总有如下的提示语, Exception in Tkinter callback
Traceback (most recent call last):
File "D:\360Downloads\af\lib\lib-tk\Tkinter.py", line 1403, in __call__
return self.func(*args)
File "D:\360Downloads\af\lib\site-packages\mglutil\gui\InputForm\Tk\gui.py", line 1251, in read_cb
f = open(newfile, 'r')
IOError: [Errno 2] No such file or directory: ''
由于小弟初学这款软件,遇到这个问题有些不知所措,所以想请您给指点下迷津!多谢多谢!
阿里大神您好,我有一个酶用autodock对接的时候,在最后显示相互作用的时候老是error:
Traceback (most recent call last)
File Fautodocklibsite-packagesViewerFrameworkVF.py, line 898, in tryto
result = command( args, kw )
File Fautodocklibsite-packagesAutoDockToolsautoanalyzeCommands.py, line 3087, in doit
self.build()
File Fautodocklibsite-packagesAutoDockToolsautoanalyzeCommands.py, line 2912, in build
self.intDescr = InteractionDescriptor(lig, macro, percentCutoff)
File Fautodocklibsite-packagesMolKitinteractionDescriptor.py, line 49, in __init__
self.build(detect_pi=detect_pi)
File Fautodocklibsite-packagesMolKitinteractionDescriptor.py, line 60, in build
self.buildCloseContactAtoms(percentCutoff) #
File Fautodocklibsite-packagesMolKitinteractionDescriptor.py, line 69, in buildCloseContactAtoms
self.macro_atoms, percentCutoff=percentCutoff)
File Fautodocklibsite-packagesMolKitdistanceSelector.py, line 106, in select
bigC = Numeric.resize(c, (lenC, lenC, 3))
File Fautodocklibsite-packagesnumpycorefromnumeric.py, line 615, in resize
a = concatenate( (a,)n_copies)
MemoryError