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Journal of Chemical Information and Modeling|August 21, 2020
Evolution of Alchemical Free Energy Methods in Drug DiscoveryLin Frank Song, Kenneth M MerzJournal of the American Chemical Society|March 7, 2020
Thermodynamics of Transition Metal Ion Binding to ProteinsLin Frank Song, Arkajyoti Sengupta, Kenneth M MerzJournal of Chemical Theory and Computation|June 20, 2020
Pair Potentials as Machine Learning FeaturesJun Pei, Lin Frank Song, Kenneth M MerzThe Journal of Physical Chemistry. B|August 23, 2014
Parameterization of highly charged metal ions using the 12-6-4 LJ-type nonbonded model in explicit waterPengfei Li, Lin Frank Song, Kenneth M MerzJournal of Chemical Information and Modeling|February 4, 2022
Effect of an Inhibitor on the ACE2-Receptor-Binding Domain of SARS-CoV-2Gaurav Sharma, Lin Frank Song, Kenneth M MerzJournal of Chemical Theory and Computation|September 23, 2021
FFENCODER-PL: Pair Wise Energy Descriptors for Protein-Ligand Pose SelectionJun Pei, Lin Frank Song, Kenneth M MerzJournal of Chemical Theory and Computation|November 18, 2015
Systematic Parameterization of Monovalent Ions Employing the Nonbonded ModelPengfei Li, Lin Frank Song, Kenneth M MerzJournal of Computer-Aided Molecular Design|August 26, 2018
Detailed potential of mean force studies on host-guest systems from the SAMPL6 challengeLin Frank Song, Nupur Bansal, Zheng Zheng, et al.Journal of Chemical Theory and Computation|June 9, 2020
Systematic Parametrization of Divalent Metal Ions for the OPC3, OPC, TIP3P-FB, and TIP4P-FB Water ModelsZhen Li, Lin Frank Song, Pengfei Li, et al.Journal of Chemical Theory and Computation|April 1, 2021
Parametrization of Trivalent and Tetravalent Metal Ions for the OPC3, OPC, TIP3P-FB, and TIP4P-FB Water ModelsZhen Li, Lin Frank Song, Pengfei Li, et al.Pageof 2