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biotite
biotite PublicForked from biotite-dev/biotite
A comprehensive library for computational molecular biology
Python
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gamd-openmm
gamd-openmm PublicForked from MiaoLab20/gamd-openmm
Gaussian Accelerated Molecular Dynamics (GaMD) is a computational method for both unconstrained enhanced sampling and free energy calculations of biomolecules. It works by adding a harmonic boost p…
Python
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