GROsolEv4.5

Calculates pairwise energies from Gromacs simulations.

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Last Update: 2016-10-17

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Calculates intermolecular energies for solvent-solvent interactions, for solvent confined to environments a few angstroms in diameter. Algorithm uses a spherical approximation to describe the confined environments geometry.

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2014-11-17

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RXNT is an ambulatory healthcare technology pioneer that empowers medical practices and healthcare organizations to succeed and scale through innovative, data-backed, AI-powered software.

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