Lee-Ping Wang
Lee-Ping Wang
Department of Chemistry, UC Davis
Verified email at - Homepage
Cited by
Cited by
OpenMM 7: Rapid development of high performance algorithms for molecular dynamics
P Eastman, J Swails, JD Chodera, RT McGibbon, Y Zhao, KA Beauchamp, ...
PLoS computational biology 13 (7), e1005659, 2017
MDTraj: a modern open library for the analysis of molecular dynamics trajectories
RT McGibbon, KA Beauchamp, MP Harrigan, C Klein, JM Swails, ...
Biophysical journal 109 (8), 1528-1532, 2015
OpenMM 4: a reusable, extensible, hardware independent library for high performance molecular simulation
P Eastman, MS Friedrichs, JD Chodera, RJ Radmer, CM Bruns, JP Ku, ...
Journal of chemical theory and computation 9 (1), 461-469, 2013
Building force fields: An automatic, systematic, and reproducible approach
LP Wang, TJ Martinez, VS Pande
The journal of physical chemistry letters 5 (11), 1885-1891, 2014
Discovering chemistry with an ab initio nanoreactor
LP Wang, A Titov, R McGibbon, F Liu, VS Pande, TJ Martínez
Nature chemistry 6 (12), 1044-1048, 2014
The diabatic picture of electron transfer, reaction barriers, and molecular dynamics
T Van Voorhis, T Kowalczyk, B Kaduk, LP Wang, CL Cheng, Q Wu
Annual review of physical chemistry 61 (1), 149-170, 2010
Systematic improvement of a classical molecular model of water
LP Wang, T Head-Gordon, JW Ponder, P Ren, JD Chodera, PK Eastman, ...
The Journal of Physical Chemistry B 117 (34), 9956-9972, 2013
Building a more predictive protein force field: a systematic and reproducible route to AMBER-FB15
LP Wang, KA McKiernan, J Gomes, KA Beauchamp, T Head-Gordon, ...
The Journal of Physical Chemistry B 121 (16), 4023-4039, 2017
Revised parameters for the AMOEBA polarizable atomic multipole water model
ML Laury, LP Wang, VS Pande, T Head-Gordon, JW Ponder
The Journal of Physical Chemistry B 119 (29), 9423-9437, 2015
TeraChem: A graphical processing unit‐accelerated electronic structure package for large‐scale ab initio molecular dynamics
S Seritan, C Bannwarth, BS Fales, EG Hohenstein, CM Isborn, ...
Wiley Interdisciplinary Reviews: Computational Molecular Science 11 (2), e1494, 2021
Systematic parametrization of polarizable force fields from quantum chemistry data
LP Wang, J Chen, T Van Voorhis
Journal of chemical theory and computation 9 (1), 452-460, 2013
Direct-Coupling O2 Bond Forming a Pathway in Cobalt Oxide Water Oxidation Catalysts
LP Wang, T Van Voorhis
The Journal of Physical Chemistry Letters 2 (17), 2200-2204, 2011
Geometry optimization made simple with translation and rotation coordinates
LP Wang, C Song
The Journal of chemical physics 144 (21), 2016
Acid− base mechanism for ruthenium water oxidation catalysts
LP Wang, Q Wu, T Van Voorhis
Inorganic chemistry 49 (10), 4543-4553, 2010
What can density functional theory tell us about artificial catalytic water splitting?
MG Mavros, T Tsuchimochi, T Kowalczyk, A McIsaac, LP Wang, ...
Inorganic chemistry 53 (13), 6386-6397, 2014
Single-cell electroporation arrays with real-time monitoring and feedback control
M Khine, C Ionescu-Zanetti, A Blatz, LP Wang, LP Lee
Lab on a Chip 7 (4), 457-462, 2007
Non-bonded force field model with advanced restrained electrostatic potential charges (RESP2)
M Schauperl, PS Nerenberg, H Jang, LP Wang, CI Bayly, DL Mobley, ...
Communications chemistry 3 (1), 44, 2020
Automated discovery and refinement of reactive molecular dynamics pathways
LP Wang, RT McGibbon, VS Pande, TJ Martinez
Journal of chemical theory and computation 12 (2), 638-649, 2016
Development and benchmarking of open force field v1. 0.0—the parsley small-molecule force field
Y Qiu, DGA Smith, S Boothroyd, H Jang, DF Hahn, J Wagner, CC Bannan, ...
Journal of chemical theory and computation 17 (10), 6262-6280, 2021
Calculations of the electric fields in liquid solutions
SD Fried, LP Wang, SG Boxer, P Ren, VS Pande
The Journal of Physical Chemistry B 117 (50), 16236-16248, 2013
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