Dear all,
In the AmberTools manual, it provides some options to carry out QM/MM-GBSA method using MMPBSA.py script. But the corresponding parts in the PBSA method is not included. Dose it mean that QM/MM-PBSA method can not carry out in Amber software? If not, how could I implement this method. Thank you in advance!
Best wishes
Duan Baogen
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Received on Thu Mar 28 2013 - 00:00:02 PDT
