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TINKER


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OS: Linux, Windows, Mac

License: Freeware

Methods: MM



TINKER is a complete package for performing empirical force field molecular mechanics and dynamics calculations.
It is intended to serve as a platform for algorithm development and parameterization, while still being efficient enough for most production work.

The available potentials include Amber ff94, ff96, ff98 and ff99, CHARMM19, CHARMM27, DANG, MM2, MM3, OPLS-UA, OPLS-AA, OPLS-AA/L and our AMOEBA polarizable atomic multipole-based potential.
Other force fields can be added via new parameter files; ENCAD and UFF are under consideration presently.

http://dasher.wustl.edu/tinker/



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