MMIC

mmic_autodock_vina

Performs molecular docking with AutoDock Vina.

mmic_cmd

Provides utilities for command-line execution.

mmic_docking

Performs molecular docking with any of the supported docking components.

mmic_ffpa

Assigns force field parameters with any of the supported forcefield assignment components.

mmic_ffpa_gmx

Assigns force field parameters to molecules based on existing force fields using Gromacs.

mmic_mda

Provides converters between MMSchema and MDAnalysis..

mmic_optim

Performs energy minimization with any of the supported optimization components.

mmic_optim_gmx

Performs energy minimization with Gromacs.

mmic_parmed

Provides converters between MMSchema and ParmEd.

mmic_qcschema

Provides converters between MMSchema and QCSchema.

mmic_translator

Converts between MMSchema and data/file objects or other specifications.

Web Analytics