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Physical Chemistry Chemical Physics : PCCP|February 25, 2022
Developing end-point methods for absolute binding free energy calculation using the Boltzmann-quasiharmonic modelLauren Wickstrom, Emilio Gallicchio, Lieyang Chen, et al.Human Cell|April 29, 2014
SMAC-armed vaccinia virus induces both apoptosis and necroptosis and synergizes the efficiency of vinblastine in HCCQiang Pan, Yuanyong Huang, Lieyang Chen, et al.Journal of Chemical Information and Modeling|December 26, 2023
Performance and Analysis of the Alchemical Transfer Method for Binding-Free-Energy Predictions of Diverse LigandsLieyang Chen, Yujie Wu, Chuanjie Wu, et al.Journal of Chemical Theory and Computation|April 8, 2021
Thermodynamic Decomposition of Solvation Free Energies with Particle Mesh Ewald and Long-Range Lennard-Jones Interactions in Grid Inhomogeneous Solvation TheoryLieyang Chen, Anthony Cruz, Daniel R Roe, et al.Chemrxiv : the Preprint Server for Chemistry|June 9, 2020
An online repository of solvation thermodynamic and structural maps of SARS-CoV-2 targetsBrian Olson, Anthony Cruz, Lieyang Chen, et al.Plos One|August 21, 2019
Hidden bias in the DUD-E dataset leads to misleading performance of deep learning in structure-based virtual screeningLieyang Chen, Anthony Cruz, Steven Ramsey, et al.Journal of Computer-Aided Molecular Design|September 12, 2020
An online repository of solvation thermodynamic and structural maps of SARS-CoV-2 targetsBrian Olson, Anthony Cruz, Lieyang Chen, et al.Pageof 1