/tools/biosimspace
biosimspace
OpenBioSim/biosimspace
summary
BioSimSpace is an interoperable Python framework that facilitates biomolecular simulations. It allows users to create and manage workflows for molecular simulations, making it suitable for various applications in computational chemistry and drug discovery.
description
An interoperable Python framework for biomolecular simulation.
topics
computational-biologycomputational-chemistrycomputational-physicsdrug-discoveryinteroperabilitymolecular-dynamicsreproducibilityreproducible-researchmolecular-simulationbiomolecular-simulationfree-energy-calculations
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