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CHARMM36

StemSkills Lab > CHARMM36
How to Choose a Force Field for Your GROMACS Simulation (CHARMM36 vs AMBER vs OPLS)
30
Jun

Decide which force field to pick at the GROMACS pdb2gmx step. Compare CHARMM36, AMBER and OPLS, and learn to justify your choice in a thesis.

Posted in: Molecular Modeling ,
Tags: AMBER , CHARMM36 , Computational Biology , Force Field , GROMACS , Molecular Dynamics ,