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Rubhashri GMP
Aug 20, 2024, 2:43:03 AM8/20/24
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How can one continue the MMPBSA calculation if it has stopped?
Kindly provide me a suggestion
With regards
G.Rubha Shri
Research Scholar
C/o Prof. Sanjeev Kumar Singh,
CADD & Molecular Modeling Lab,
Department of Bioinformatics,
Alagappa University.
mariosergi...@gmail.com
Aug 20, 2024, 9:25:39 AM8/20/24
to gmx_MMPBSA
Unfortunately, this is not possible. You must rerun the calculation. Please, remember that you can accelerate the calculation using mpi
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