Example of QM/MM solvation free energy calculation input file fails
Just Got Here
1:42:37 AM PDT - Fri, Oct 19th 2012
Hello,
I tried running the example provided for free enargy calculations but it fails.
Can you help me with this ?
Thanks.
Xin Li
Clicked A Few Times
6:11:13 AM PST - Mon, Dec 24th 2012
Possible help to you
Xin Li,
I think the following link may help you.
http://nwchemgit.github.io/Special_AWCforum/st/id567/Error_in_NWChem_Analysis_Modu...
Jingbo
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