Search

Catalysis

Working Paper

Ruthenium Complex Hydride Catalysts as a Platform for Ammonia Synthesis

Qianru Wang, Jianping Guo, Ping Chen

Version 1 posted 16 March 2021

766

Downloads

Theoretical and Computational Chemistry

Working Paper

Force Field Partial Charges with Restrained Electrostatic Potential 2 (RESP2)

Michael Schauperl, Paul Nerenberg, Hyesu Jang, Lee-Ping Wang, Christopher I. Bayly, David Mobley, Michael Gilson

Version 1 posted 31 October 2019

1,469

Downloads

4

Citations

Organic Chemistry

Working Paper

Pd-Catalysed Migratory 1,1-Cycloannulation Reaction of Alkenes

Jin-Ping Wang, Tao Liu, Yichen Wu, Peng Wang

Version 1 posted 16 September 2024

652

Downloads

Agriculture and Food Chemistry

Review

Comprehensive Analysis of Penicillium Sclerotiorum: Biology, Secondary Metabolites, and Bioactive Compound potential- review

jahan israt, Jian Yan, Yihan Wang, Ping Li, Sarfaraz Hussain, Jiayi Song

Version 1 posted 29 January 2024

238

Downloads

Theoretical and Computational Chemistry

Working Paper

Benchmarking Quantum Mechanical Levels of Theory for Valence Parametrization in Force Fields

Pavan Kumar Behara, Hyesu Jang, Joshua Horton, Trevor Gokey, David Dotson, Simon Boothroyd, Christopher Bayly, Daniel Cole, Lee-Ping Wang, David Mobley

Version 3 posted 14 May 2024

691

Downloads

Polymer Science

Working Paper

Effect of Pre-Damage on the Fracture Energy of Double-Network Hydrogels

Yong Zheng, Yiru Wang, Tasuku Nakajima, Jian Ping Gong

Version 1 posted 20 December 2023

260

Downloads

Theoretical and Computational Chemistry

Working Paper

Benchmarking Density Functionals, Basis Sets, and Solvent Models in Predicting Thermodynamic Hydricities of Organic Hydrides

Christina Yeo, Minh Nguyen, Lee-Ping Wang

Version 2 posted 27 September 2022

561

Downloads

Theoretical and Computational Chemistry

Working Paper

Tuning Potential Functions to Host–Guest Binding Data

Jeffry Setiadi, Simon Boothroyd, David Slochower, David Dotson, Matthew Thompson, Jeffrey Wagner, Lee-Ping Wang, Michael K. Gilson

Version 2 posted 14 December 2023

492

Downloads

Theoretical and Computational Chemistry

Working Paper

Binding thermodynamics of host-guest systems with SMIRNOFF99Frosst 1.0.5 from the Open Force Field Initiative

David Slochower, Niel Henriksen, Lee-Ping Wang, John Chodera, David Mobley, Michael Gilson

Version 2 posted 06 September 2019

1,649

Downloads

Physical Chemistry

Working Paper

Systematic Optimization of Water Models Using Liquid/Vapor Surface Tension Data

Yudong Qiu, Paul S. Nerenberg, Teresa Head-Gordon, Lee-Ping Wang

Version 1 posted 23 April 2019

907

Downloads

Refine Search

39 results in Ping Wang in Authors: Ping Wang

Ruthenium Complex Hydride Catalysts as a Platform for Ammonia Synthesis

Force Field Partial Charges with Restrained Electrostatic Potential 2 (RESP2)

Pd-Catalysed Migratory 1,1-Cycloannulation Reaction of Alkenes

Comprehensive Analysis of Penicillium Sclerotiorum: Biology, Secondary Metabolites, and Bioactive Compound potential- review

Benchmarking Quantum Mechanical Levels of Theory for Valence Parametrization in Force Fields

Effect of Pre-Damage on the Fracture Energy of Double-Network Hydrogels

Benchmarking Density Functionals, Basis Sets, and Solvent Models in Predicting Thermodynamic Hydricities of Organic Hydrides

Tuning Potential Functions to Host–Guest Binding Data

Binding thermodynamics of host-guest systems with SMIRNOFF99Frosst 1.0.5 from the Open Force Field Initiative

Systematic Optimization of Water Models Using Liquid/Vapor Surface Tension Data

39 results in Authors: Ping Wang