Dear all,
I am trying to calculate binding free energy using MMPBSA.py of an enzyme and i am getting the error attached here as jpeg file.I google the error and got suggestion of using inp=1 and radiopt=0, but even then its giving the same error. The input file is also attached here.
Regards,Hira
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- application/octet-stream attachment: mmpbsa.in
- application/octet-stream attachment: pbsa.jp2
Received on Tue Mar 01 2016 - 22:00:03 PST
