CHARMM

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CHARMM (Chemistry at HARvard Molecular Mechanics) is a program for macromolecular simulations, including energy minimization, molecular dynamics and Monte Carlo and also is the name of a widely used set of force fields for molecular dynamics.

Force field

Functional form

Parameters

References

Related reading

Journal of Computational Chemistry Virtual Issue: "CHARMM and the Development of Methods and Techniques in Molecular Mechanics" August (2009)

Extermal links

CHARMM home page

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