Monte Carlo on the manifold and MD refinement for binding pose prediction of protein–ligand complexes: 2017 D3R Grand Challenge - Concepedia

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Monte Carlo on the manifold and MD refinement for binding pose prediction of protein–ligand complexes: 2017 D3R Grand Challenge

DOI Full Paper Access

14

Citations

26

References

2018

Year

Mikhail Ignatov, Cong Liu, Andrey Alekseenko, Zhuyezi Sun, Dzmitry Padhorny, Sergei Kotelnikov, Andrey Kazennov, Ivan Grebenkin, Yaroslav Kholodov, Istvan Kolosvari,

Journal of Computer-Aided Molecular Design

EngineeringBiomolecular Structure PredictionPose PredictionMedicineMonte CarloComputational BiologyMolecular BiologyMd RefinementProtein ModelingProtein Structure PredictionMolecular SimulationComputational ModelingMolecular DockingMolecular ModelingBiophysicsMacromolecular AssembliesStructural Biology

References

	Year	Citations

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