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Spectral Rate Theory for Two-State Kinetics by Jan-Hendrik Prinz, John D. Chodera, Frank Noé
Published 2014-02-01
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SPICE, A Dataset of Drug-like Molecules and Peptides for Training Machine Learning Potentials by Peter Eastman, Pavan Kumar Behara, David L. Dotson, Raimondas Galvelis, John E. Herr, Josh T. Horton, Yuezhi Mao, John D. Chodera, Benjamin P. Pritchard, Yuanqing Wang, Gianni De Fabritiis, Thomas E. Markland
Published 2023-01-01
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