Dear Amber users,
It is not clear to me how I can set the parameter in the input file for MMPBSA.py to calculate the pb part using nonlinear PB equation via APBS (set nonlin=1 in _MMPBSA_pb.mdin file). Could you let me know how I can achieve that? If it is needed to modified the script, could you point out which part of the script should I change? Thanks a lot!
Best,
Wei
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Received on Tue Jul 19 2011 - 10:30:02 PDT
