I need calculate MM/PBSA with MMPBSA.py but in output file "MMPBSA_info" the temperature is marked for default in -INPUT['temp'] = 298.15 and y need run that analysis in 310 k, I looking in amber manual but I do not find how to do this.
Thanks.
Thanks for answer, in the Script output and input files the temperature for the analysis its configured for default in 298k.
if you want to change temperature, this must be modified in the simulations since MMPBSA only takes the conformations obtained through simulations.
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