Open AccessMarkov State Modelling Reveals Heterogeneous Drug-Inhibition Mechanism of Calmodulin
Author(s) -
Annie M. Westerlund,
Akshay Sridhar,
Leo Dahl,
Alma Andersson,
Anna-Yaroslava Bodnar,
Lucie Delemotte
Publication year - 2022
Publication title -
zenodo (cern european organization for nuclear research)
Language(s) - Uncategorized
DOI - 10.5281/zenodo.6626415
Subject(s) - mechanism (biology) , drug , markov chain , calmodulin , chemistry , computer science , computational biology , biophysics , statistical physics , pharmacology , biology , calcium , physics , machine learning , organic chemistry , quantum mechanics
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