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Comparison of force-field implementations

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Computer programs implementing molecular mechanics Force Fields.


OPLS AMBER CHARMM GROMACS MMFF UFF Comments
AMBER + +
ArgusLab + + addition to Quantum Chemistry
Ascalaph UA 94
BOSS UA, AA
CHARMM +
GROMACS +
MOE AA 89, 94, 99 22, 27 94(s)
NAMD +
TINKER UA, AA, AA/L 94, 96, 98, 99 19, 27 for proteins only
Towhee UA, AA 86 19, 22, 27 94 + Monte Carlo

See also

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