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David Calkins

Showing results (1-10 of 4) with videos related to

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Journal of Chemical Information and Modeling|November 1, 2016
Automated Protocol for Large-Scale Modeling of Gene Expression DataMichelle Lynn Hall, David Calkins, Woody Sherman
Journal of Chemical Information and Modeling|December 9, 2010
Comments on the article "Evaluation of pK(a) estimation methods on 211 druglike compounds"John C Shelley, David Calkins, Arron P Sullivan
Journal of Computer-Aided Molecular Design|April 1, 2010
Towards the comprehensive, rapid, and accurate prediction of the favorable tautomeric states of drug-like molecules in aqueous solutionJeremy R Greenwood, David Calkins, Arron P Sullivan, et al.
Journal of Chemical Theory and Computation|April 6, 2023
Epik: p<i>K</i><sub>a</sub> and Protonation State Prediction through Machine LearningRyne C Johnston, Kun Yao, Zachary Kaplan, et al.
Pageof 1

Showing results (1-10 of 4) with videos related to

Sort By:
Pageof 1
Journal of Chemical Information and Modeling|November 1, 2016
Automated Protocol for Large-Scale Modeling of Gene Expression DataMichelle Lynn Hall, David Calkins, Woody Sherman
Journal of Chemical Information and Modeling|December 9, 2010
Comments on the article "Evaluation of pK(a) estimation methods on 211 druglike compounds"John C Shelley, David Calkins, Arron P Sullivan
Journal of Computer-Aided Molecular Design|April 1, 2010
Towards the comprehensive, rapid, and accurate prediction of the favorable tautomeric states of drug-like molecules in aqueous solutionJeremy R Greenwood, David Calkins, Arron P Sullivan, et al.
Journal of Chemical Theory and Computation|April 6, 2023
Epik: p<i>K</i><sub>a</sub> and Protonation State Prediction through Machine LearningRyne C Johnston, Kun Yao, Zachary Kaplan, et al.
Pageof 1