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Timothy L Fletcher

Showing results (1-10 of 6) with videos related to

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Journal of Chemical Theory and Computation|May 26, 2016
Multipolar Electrostatic Energy Prediction for all 20 Natural Amino Acids Using Kriging Machine LearningTimothy L Fletcher, Paul L A Popelier
Journal of Computational Chemistry|December 20, 2016
Toward amino acid typing for proteins in FFLUXTimothy L Fletcher, Paul L A Popelier
Journal of Computational Chemistry|March 16, 2017
FFLUX: Transferability of polarizable machine-learned electrostatics in peptide chainsTimothy L Fletcher, Paul L A Popelier
Journal of Chemical Theory and Computation|November 21, 2015
Prediction of Intramolecular Polarization of Aromatic Amino Acids Using Kriging Machine LearningTimothy L Fletcher, Stuart J Davie, Paul L A Popelier
Journal of Computational Chemistry|May 31, 2013
Accuracy and tractability of a kriging model of intramolecular polarizable multipolar electrostatics and its application to histidineShaun M Kandathil, Timothy L Fletcher, Yongna Yuan, et al.
Scientific Reports|October 11, 2017
Geometry Optimization with Machine Trained Topological AtomsFrançois Zielinski, Peter I Maxwell, Timothy L Fletcher, et al.
Pageof 1

Showing results (1-10 of 6) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|May 26, 2016
Multipolar Electrostatic Energy Prediction for all 20 Natural Amino Acids Using Kriging Machine LearningTimothy L Fletcher, Paul L A Popelier
Journal of Computational Chemistry|December 20, 2016
Toward amino acid typing for proteins in FFLUXTimothy L Fletcher, Paul L A Popelier
Journal of Computational Chemistry|March 16, 2017
FFLUX: Transferability of polarizable machine-learned electrostatics in peptide chainsTimothy L Fletcher, Paul L A Popelier
Journal of Chemical Theory and Computation|November 21, 2015
Prediction of Intramolecular Polarization of Aromatic Amino Acids Using Kriging Machine LearningTimothy L Fletcher, Stuart J Davie, Paul L A Popelier
Journal of Computational Chemistry|May 31, 2013
Accuracy and tractability of a kriging model of intramolecular polarizable multipolar electrostatics and its application to histidineShaun M Kandathil, Timothy L Fletcher, Yongna Yuan, et al.
Scientific Reports|October 11, 2017
Geometry Optimization with Machine Trained Topological AtomsFrançois Zielinski, Peter I Maxwell, Timothy L Fletcher, et al.
Pageof 1