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List of works by Robert T. McGibbon

Automated Discovery and Refinement of Reactive Molecular Dynamics Pathways

scientific article published on 18 December 2015

Discovering chemistry with an ab initio nanoreactor

scientific article

Erratum: Corrigendum: Discovering chemistry with an ab initio nanoreactor

scientific article published on 17 December 2014

Identification of simple reaction coordinates from complex dynamics. ⬇️

scientific article published in January 2017

Improving the accuracy of Møller-Plesset perturbation theory with neural networks.

scientific article

MDTraj: A Modern Open Library for the Analysis of Molecular Dynamics Trajectories.

scientific article published in October 2015

MSMBuilder: Statistical Models for Biomolecular Dynamics.

scientific article

OpenMM 7: Rapid development of high performance algorithms for molecular dynamics.

scientific article

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