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19800617捐助貴賓 (初入文壇)
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[求助]
分子對(duì)接軟件autodock運(yùn)行問(wèn)題 已有1人參與
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用autodock 4.2.6配合MGLTools1.5.6 做個(gè)例子,對(duì)接完成使用“Analyze->Open”打開(kāi)剛才生成的.dlg文件時(shí)彈出文本窗口,出現(xiàn)了以下的錯(cuò)誤提示: Python 2.5.2 (r252:60911, Feb 21 2008, 13:11:45) [MSC v.1310 32 bit (Intel)] on win32 Type "copyright", "credits" or "license()" for more information. **************************************************************** Personal firewall software may warn about the connection IDLE makes to its subprocess using this computer's internal loopback interface. This connection is not visible on any external interface and no data is sent to or received from the Internet. **************************************************************** IDLE 1.2.2 ==== No Subprocess ==== >>> exception in _buildInputLig ERROR ********************************************* Traceback (most recent call last): File "C:\Program Files (x86)\MGLTools-1.5.6\lib\site-packages\ViewerFramework\VF.py", line 898, in tryto result = command( *args, **kw ) File "C:\Program Files (x86)\MGLTools-1.5.6\lib\site-packages\AutoDockTools\autoanalyzeCommands.py", line 3852, in doit d.readDlg(dlgFile) File "C:\Program Files (x86)\MGLTools-1.5.6\lib\site-packages\AutoDockTools\Docking.py", line 105, in readDlg self.ch = ConformationHandler(self.ligMol, AttributeError: Docking instance has no attribute 'ligMol' 試了幾次都是這樣,win10系統(tǒng),求助各位有人遇到過(guò)類似問(wèn)題么。 |
鐵桿木蟲(chóng) (著名寫(xiě)手)
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