Machine Learning in Biomolecular Simulations - Frontiers Media SA 2019 - 1 online resource (129 p.)

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English

978-2-88963-136-0 9782889631360

10.3389/978-2-88963-136-0 doi


Science: general issues

collective variable intrinsically disordered proteins kinetics ligand design machine learning molecular dynamics computer simulation molecular modeling non-linear dimensionality reduction sampling enhancement