24小时热门版块排行榜

返回列表

YILUK

金虫 (小有名气)

应助: 3 (幼儿园)
金币: 1071.3
散金: 2
红花: 1
帖子: 139
在线: 249.7小时
虫号: 664530
注册: 2008-11-29
性别: GG
专业: 放射医学

[求助] 用AutoDock做对接，在分析氨基酸残基的时候出错，是神马意思？？

错误代码如下：
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 ====
>>> ERROR *********************************************
Traceback (most recent call last):
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\ViewerFramework\VF.py", line 898, in tryto
result = command( *args, **kw )
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\AutoDockTools\autoanalyzeCommands.py", line 3087, in doit
self.build()
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\AutoDockTools\autoanalyzeCommands.py", line 2912, in build
self.intDescr = InteractionDescriptor(lig, macro, percentCutoff)
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\MolKit\interactionDescriptor.py", line 49, in __init__
self.build(detect_pi=detect_pi)
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\MolKit\interactionDescriptor.py", line 60, in build
self.buildCloseContactAtoms(percentCutoff)             #
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\MolKit\interactionDescriptor.py", line 69, in buildCloseContactAtoms
self.macro_atoms, percentCutoff=percentCutoff)
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\MolKit\distanceSelector.py", line 111, in select
cutoff = self.setupCutoff(checkAts, keyAts, cutoff)
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\MolKit\distanceSelector.py", line 219, in setupCutoff
bigRC = Numeric.resize(checkRadii, (lenC, lenC))
  File "C:\Program Files\MGLTools-1.5.6\lib\site-packages\numpy\core\fromnumeric.py", line 615, in resize
a = concatenate( (a,)*n_copies)
MemoryError

求高手解答，不胜感激

回复此楼