doi.bio/wei_yang


Wei Yang Wei Yang

Early Life and Education

Yang was born in Shanghai, China in 1963. She entered Fudan University in 1980, before transferring to Stony Brook University in the United States in 1983, where she earned her B.A. degree. She then went on to receive her M.A. (1985) and Ph.D. (1991) in Biochemistry & Molecular Biophysics from Columbia University.

Career

Since 1995, Yang has been a senior scientist in the Laboratory of Molecular Biology at the National Institutes of Health. Her research primarily focuses on DNA mismatch repair, translesion synthesis, and V(D)J recombination. Her lab has made significant discoveries, including that DNA synthesis, and RNA degradation reactions are propelled by cation trafficking and require transiently bound Mg²⁺ and K⁺ ions, which are absent in static structures.

Awards and Honours

Selected Publications

Google Scholar Profile

Wei Yang)

Google Scholar

Wei Yang Florida State University N/A CHARMM: the biomolecular simulation program BR Brooks, CL Brooks, AD MacKerell, L Nilsson, RJ Petrella, B Roux, … Journal of Computational Chemistry 30 (10), 1545-1614, 2009 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:u5HHmVD_uO8C Cited by: 8742

Structure of a repair enzyme interrogating undamaged DNA elucidates recognition of damaged DNA A Banerjee, W Yang, M Karplus, GL Verdine Nature 434 (7033), 612-618, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:z_wVstp3MssC Cited by: 420

Random walk in orthogonal space to achieve efficient free-energy simulation of complex systems L Zheng, M Chen, W Yang Proceedings of the National Academy of Sciences 105 (51), 20227-20232, 2008 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:aqlVkmm33-oC Cited by: 338

Computer‐guided design in molecular recognition: Design and synthesis of a glucopyranose receptor W Yang, H He, DG Drueckhammer Angewandte Chemie International Edition 40 (9), 1714-1718, 2001 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:35r97b3x0nAC Cited by: 295

A fast and high-quality charge model for the next generation general AMBER force field X He, VH Man, W Yang, TS Lee, J Wang The Journal of Chemical Physics 153 (11), 114502, 2020 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:g5Ck-dwhA_QC Cited by: 282

Product-assisted catalysis in base-excision DNA repair JC Fromme, SD Bruner, W Yang, M Karplus, GL Verdine Nature Structural Biology 10 (3), 204-211, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:M3ejUd6NZC8C Cited by: 207

A structure-based model for the synthesis and hydrolysis of ATP by F1-ATPase YQ Gao, W Yang, M Karplus Cell 123 (2), 195-205, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:4TOpqqG69KYC Cited by: 180

Understanding the relative acyl-transfer reactivity of oxoesters and thioesters: Computational analysis of transition state delocalization effects W Yang, DG Drueckhammer Journal of the American Chemical Society 123 (44), 11004-11009, 2001 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:-_dYPAW6P2MC Cited by: 157

The missing link between thermodynamics and structure in F1-ATPase W Yang, YQ Gao, Q Cui, J Ma, M Karplus Proceedings of the National Academy of Sciences 100 (3), 874-879, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:7PzlFSSx8tAC Cited by: 130

Modeling structural coordination and ligand binding in zinc proteins with a polarizable potential J Zhang, W Yang, JP Piquemal, P Ren Journal of Chemical Theory and Computation 8 (4), 1314-1324, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:V3AGJWp-ZtQC Cited by: 125

Free energy simulations: Use of reverse cumulative averaging to determine the equilibrated region and the time required for convergence W Yang, R Bitetti-Putzer, M Karplus The Journal of Chemical Physics 120, 2618, 2004 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:4JMBOYKVnBMC Cited by: 119

Practically efficient and robust free energy calculations: Double-integration orthogonal space tempering L Zheng, W Yang Journal of Chemical Theory and Computation 8 (3), 810-823, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:wbdj-CoPYUoC Cited by: 107

Simultaneous escaping of explicit and hidden free energy barriers: Application of the orthogonal space random walk strategy in generalized ensemble based conformational sampling L Zheng, M Chen, W Yang The Journal of Chemical Physics 130, 234105, 2009 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:g5m5HwL7SMYC Cited by: 105

Simulated scaling method for localized enhanced sampling and simultaneous “alchemical” free energy simulations: A general method for molecular mechanical, quantum mechanical … H Li, M Fajer, W Yang The Journal of Chemical Physics 126, 024106, 2007 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:dhFuZR0502QC Cited by: 105

Computational studies of the aminolysis of oxoesters and thioesters in aqueous solution W Yang, DG Drueckhammer Organic Letters 2 (26), 4133-4136, 2000 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:fEOibwPWpKIC Cited by: 102

The structure, thermodynamics, and solubility of organic crystals from simulation with a polarizable force field MJ Schnieders, J Baltrusaitis, Y Shi, G Chattree, L Zheng, W Yang, P Ren Journal of Chemical Theory and Computation 8 (5), 1721-1736, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:5ugPr518TE4C Cited by: 95

Generalized ensembles serve to improve the convergence of free energy simulations R Bitetti-Putzer, W Yang, M Karplus Chemical Physics Letters 377 (5), 633-641, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:lSLTfruPkqcC Cited by: 68

A model for the cooperative free energy transduction and kinetics of ATP hydrolysis by F1-ATPase YQ Gao, W Yang, RA Marcus, M Karplus Proceedings of the National Academy of Sciences 100 (20), 11339-11344, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:bEWYMUwI8FkC Cited by: 66

Protein structural transitions and their functional role M Karplus, YQ Gao, J Ma, A van der Vaart, W Yang Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:blknAaTinKkC Cited by: 65

Finite reservoir replica exchange to enhance canonical sampling in rugged energy surfaces H Li, G Li, BA Berg, W Yang The Journal of Chemical Physics 125 (14), 144902, 2006 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:ldfaerwXgEUC Cited by: 60

Co-authors

Lianqing Zheng googlescholarauthorid:IbQbm4AAAAJ

Pengyu Ren googlescholarauthor_id:7Nxd0zcAAAAJ

Mikolai Fajer googlescholarauthor_id:oTvKLA8AAAAJ

Gregory Verdine googlescholarauthor_id:H6EGIrQAAAAJ

Bernd A Berg googlescholarauthor_id:4EKKyosAAAAJ

Qiang Cui googlescholarauthor_id:4x1QeogAAAAJ

Dongsheng Wu googlescholarauthor_id:p7MeBuYAAAAJ

J. Christopher Fromme googlescholarauthor_id:MoIdJDcAAAAJ

Jean-Philip Piquemal googlescholarauthor_id:z0cOrb0AAAAJ

Kenneth M. Merz Jr. googlescholarauthorid:vhpRAwAAAAJ

John C. Faver googlescholarauthor_id:ngoqSMgAAAAJ

Ray Luo googlescholarauthor_id:CONRN6AAAAAJ

Michael J. Schnieders googlescholarauthor_id:sXWbF2sAAAAJ

Liaoran Cao googlescholarauthor_id:BXi84Z8AAAAJ

Arjan van der Vaart googlescholarauthor_id:VdJU2EYAAAAJ

Jin Wang googlescholarauthor_id:DsmlgfcAAAAJ

Rebecca Terns, Ph.D. googlescholarauthor_id:EQ4EHpgAAAAJ

Michael Terns googlescholarauthor_id:CBklIWkAAAAJ

Emil Alexov googlescholarauthorid:0B09LgAAAAJ

Xiaolin Cheng googlescholarauthor_id:lh1C5dkAAAAJ

Google Scholar

Wei Yang Florida State University N/A CHARMM: the biomolecular simulation program BR Brooks, CL Brooks, AD MacKerell, L Nilsson, RJ Petrella, B Roux, … Journal of Computational Chemistry 30 (10), 1545-1614, 2009 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:u5HHmVD_uO8C Cited by: 8742

Structure of a repair enzyme interrogating undamaged DNA elucidates recognition of damaged DNA A Banerjee, W Yang, M Karplus, GL Verdine Nature 434 (7033), 612-618, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:z_wVstp3MssC Cited by: 420

Random walk in orthogonal space to achieve efficient free-energy simulation of complex systems L Zheng, M Chen, W Yang Proceedings of the National Academy of Sciences 105 (51), 20227-20232, 2008 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:aqlVkmm33-oC Cited by: 338

Computer‐guided design in molecular recognition: Design and synthesis of a glucopyranose receptor W Yang, H He, DG Drueckhammer Angewandte Chemie International Edition 40 (9), 1714-1718, 2001 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:35r97b3x0nAC Cited by: 295

A fast and high-quality charge model for the next generation general AMBER force field X He, VH Man, W Yang, TS Lee, J Wang The Journal of Chemical Physics 153 (11), 114502, 2020 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:g5Ck-dwhA_QC Cited by: 282

Product-assisted catalysis in base-excision DNA repair JC Fromme, SD Bruner, W Yang, M Karplus, GL Verdine Nature Structural Biology 10 (3), 204-211, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:M3ejUd6NZC8C Cited by: 207

A structure-based model for the synthesis and hydrolysis of ATP by F1-ATPase YQ Gao, W Yang, M Karplus Cell 123 (2), 195-205, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:4TOpqqG69KYC Cited by: 180

Understanding the relative acyl-transfer reactivity of oxoesters and thioesters: Computational analysis of transition state delocalization effects W Yang, DG Drueckhammer Journal of the American Chemical Society 123 (44), 11004-11009, 2001 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:-_dYPAW6P2MC Cited by: 157

The missing link between thermodynamics and structure in F1-ATPase W Yang, YQ Gao, Q Cui, J Ma, M Karplus Proceedings of the National Academy of Sciences 100 (3), 874-879, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:7PzlFSSx8tAC Cited by: 130

Modeling structural coordination and ligand binding in zinc proteins with a polarizable potential J Zhang, W Yang, JP Piquemal, P Ren Journal of Chemical Theory and Computation 8 (4), 1314-1324, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:V3AGJWp-ZtQC Cited by: 125

Free energy simulations: Use of reverse cumulative averaging to determine the equilibrated region and the time required for convergence W Yang, R Bitetti-Putzer, M Karplus The Journal of Chemical Physics 120, 2618, 2004 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:4JMBOYKVnBMC Cited by: 119

Practically efficient and robust free energy calculations: Double-integration orthogonal space tempering L Zheng, W Yang Journal of Chemical Theory and Computation 8 (3), 810-823, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:wbdj-CoPYUoC Cited by: 107

Simultaneous escaping of explicit and hidden free energy barriers: Application of the orthogonal space random walk strategy in generalized ensemble based conformational sampling L Zheng, M Chen, W Yang The Journal of Chemical Physics 130, 234105, 2009 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:g5m5HwL7SMYC Cited by: 105

Simulated scaling method for localized enhanced sampling and simultaneous “alchemical” free energy simulations: A general method for molecular mechanical, quantum mechanical … H Li, M Fajer, W Yang The Journal of Chemical Physics 126, 024106, 2007 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:dhFuZR0502QC Cited by: 105

Computational studies of the aminolysis of oxoesters and thioesters in aqueous solution W Yang, DG Drueckhammer Organic Letters 2 (26), 4133-4136, 2000 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:fEOibwPWpKIC Cited by: 102

The structure, thermodynamics, and solubility of organic crystals from simulation with a polarizable force field MJ Schnieders, J Baltrusaitis, Y Shi, G Chattree, L Zheng, W Yang, P Ren Journal of Chemical Theory and Computation 8 (5), 1721-1736, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:5ugPr518TE4C Cited by: 95

Generalized ensembles serve to improve the convergence of free energy simulations R Bitetti-Putzer, W Yang, M Karplus Chemical Physics Letters 377 (5), 633-641, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:lSLTfruPkqcC Cited by: 68

A model for the cooperative free energy transduction and kinetics of ATP hydrolysis by F1-ATPase YQ Gao, W Yang, RA Marcus, M Karplus Proceedings of the National Academy of Sciences 100 (20), 11339-11344, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:bEWYMUwI8FkC Cited by: 66

Protein structural transitions and their functional role M Karplus, YQ Gao, J Ma, A van der Vaart, W Yang Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:blknAaTinKkC Cited by: 65

Finite reservoir replica exchange to enhance canonical sampling in rugged energy surfaces H Li, G Li, BA Berg, W Yang The Journal of Chemical Physics 125 (14), 144902, 2006 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:ldfaerwXgEUC Cited by: 60

Co-authors

Lianqing Zheng googlescholarauthorid lianqingzheng.md:IbQbm_4AAAAJ

Pengyu Ren googlescholarauthorid pengyuren.md:7Nxd0zcAAAAJ

Mikolai Fajer googlescholarauthorid mikolaifajer.md:oTvKLA8AAAAJ

Gregory Verdine googlescholarauthorid gregoryverdine.md:H6EGIrQAAAAJ

Bernd A Berg googlescholarauthorid bernda_berg.md:4EKKyosAAAAJ

Qiang Cui googlescholarauthorid qiangcui.md:4x1QeogAAAAJ

Dongsheng Wu googlescholarauthorid dongshengwu.md:p7MeBuYAAAAJ

J. Christopher Fromme googlescholarauthorid j.christopher_fromme.md:MoIdJDcAAAAJ

Jean-Philip Piquemal googlescholarauthorid jean-philippiquemal.md:z0cOrb0AAAAJ

Kenneth M. Merz Jr. googlescholarauthorid kennethm.merzjr..md:vhpR_AwAAAAJ

John C. Faver googlescholarauthorid johnc._faver.md:ngoqSMgAAAAJ

Ray Luo googlescholarauthorid rayluo.md:CONRN6AAAAAJ

Michael J. Schnieders googlescholarauthorid michaelj._schnieders.md:sXWbF2sAAAAJ

Liaoran Cao googlescholarauthorid liaorancao.md:BXi84Z8AAAAJ

Arjan van der Vaart googlescholarauthorid arjanvandervaart.md:VdJU2EYAAAAJ

Jin Wang googlescholarauthorid jinwang.md:DsmlgfcAAAAJ

Rebecca Terns, Ph.D. googlescholarauthorid rebeccaterns,_ph.d..md:EQ4EHpgAAAAJ

Michael Terns googlescholarauthorid michaelterns.md:CBklIWkAAAAJ

Emil Alexov googlescholarauthorid emilalexov.md:0B0_9LgAAAAJ

Xiaolin Cheng googlescholarauthorid xiaolincheng.md:lh1C5dkAAAAJ

Google Scholar

Wei Yang

Florida State University

N/A

CHARMM: the biomolecular simulation program BR Brooks, CL Brooks, AD MacKerell, L Nilsson, RJ Petrella, B Roux, … Journal of Computational Chemistry 30 (10), 1545-1614, 2009 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:u5HHmVD_uO8C

Structure of a repair enzyme interrogating undamaged DNA elucidates recognition of damaged DNA A Banerjee, W Yang, M Karplus, GL Verdine Nature 434 (7033), 612-618, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:z_wVstp3MssC

Random walk in orthogonal space to achieve efficient free-energy simulation of complex systems L Zheng, M Chen, W Yang Proceedings of the National Academy of Sciences 105 (51), 20227-20232, 2008 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:aqlVkmm33-oC

Computer‐guided design in molecular recognition: Design and synthesis of a glucopyranose receptor W Yang, H He, DG Drueckhammer Angewandte Chemie International Edition 40 (9), 1714-1718, 2001 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:35r97b3x0nAC

A fast and high-quality charge model for the next generation general AMBER force field X He, VH Man, W Yang, TS Lee, J Wang The Journal of Chemical Physics 153 (11), 114502, 2020 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:g5Ck-dwhA_QC

Product-assisted catalysis in base-excision DNA repair JC Fromme, SD Bruner, W Yang, M Karplus, GL Verdine Nature Structural Biology 10 (3), 204-211, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:M3ejUd6NZC8C

A structure-based model for the synthesis and hydrolysis of ATP by F1-ATPase YQ Gao, W Yang, M Karplus Cell 123 (2), 195-205, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:4TOpqqG69KYC

Understanding the relative acyl-transfer reactivity of oxoesters and thioesters: Computational analysis of transition state delocalization effects W Yang, DG Drueckhammer Journal of the American Chemical Society 123 (44), 11004-11009, 2001 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:-_dYPAW6P2MC

The missing link between thermodynamics and structure in F1-ATPase W Yang, YQ Gao, Q Cui, J Ma, M Karplus Proceedings of the National Academy of Sciences 100 (3), 874-879, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:7PzlFSSx8tAC

Modeling structural coordination and ligand binding in zinc proteins with a polarizable potential J Zhang, W Yang, JP Piquemal, P Ren Journal of Chemical Theory and Computation 8 (4), 1314-1324, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:V3AGJWp-ZtQC

Free energy simulations: Use of reverse cumulative averaging to determine the equilibrated region and the time required for convergence W Yang, R Bitetti-Putzer, M Karplus The Journal of Chemical Physics 120, 2618, 2004 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:4JMBOYKVnBMC

Practically efficient and robust free energy calculations: Double-integration orthogonal space tempering L Zheng, W Yang Journal of Chemical Theory and Computation 8 (3), 810-823, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:wbdj-CoPYUoC

Simultaneous escaping of explicit and hidden free energy barriers: Application of the orthogonal space random walk strategy in generalized ensemble based conformational sampling L Zheng, M Chen, W Yang The Journal of Chemical Physics 130, 234105, 2009 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:g5m5HwL7SMYC

Simulated scaling method for localized enhanced sampling and simultaneous “alchemical” free energy simulations: A general method for molecular mechanical, quantum mechanical … H Li, M Fajer, W Yang The Journal of Chemical Physics 126, 024106, 2007 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:dhFuZR0502QC

Computational studies of the aminolysis of oxoesters and thioesters in aqueous solution W Yang, DG Drueckhammer Organic Letters 2 (26), 4133-4136, 2000 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:fEOibwPWpKIC

The structure, thermodynamics, and solubility of organic crystals from simulation with a polarizable force field MJ Schnieders, J Baltrusaitis, Y Shi, G Chattree, L Zheng, W Yang, P Ren Journal of Chemical Theory and Computation 8 (5), 1721-1736, 2012 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:5ugPr518TE4C

Generalized ensembles serve to improve the convergence of free energy simulations R Bitetti-Putzer, W Yang, M Karplus Chemical Physics Letters 377 (5), 633-641, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:lSLTfruPkqcC

A model for the cooperative free energy transduction and kinetics of ATP hydrolysis by F1-ATPase YQ Gao, W Yang, RA Marcus, M Karplus Proceedings of the National Academy of Sciences 100 (20), 11339-11344, 2003 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:bEWYMUwI8FkC

Protein structural transitions and their functional role M Karplus, YQ Gao, J Ma, A van der Vaart, W Yang Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2005 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:blknAaTinKkC

Finite reservoir replica exchange to enhance canonical sampling in rugged energy surfaces H Li, G Li, BA Berg, W Yang The Journal of Chemical Physics 125 (14), 144902, 2006 Link: https://scholar.google.com/citations?viewop=viewcitation&hl=en&user=nONu6v0AAAAJ&citationforview=nONu6v0AAAAJ:ldfaerwXgEUC

Co-authors

Lianqing Zheng googlescholarauthorid lianqingzheng.md:IbQbm_4AAAAJ

Pengyu Ren googlescholarauthorid pengyuren.md:7Nxd0zcAAAAJ

Mikolai Fajer googlescholarauthorid mikolaifajer.md:oTvKLA8AAAAJ

Gregory Verdine googlescholarauthorid gregoryverdine.md:H6EGIrQAAAAJ

Bernd A Berg googlescholarauthorid bernda_berg.md:4EKKyosAAAAJ

Qiang Cui googlescholarauthorid qiangcui.md:4x1QeogAAAAJ

Dongsheng Wu googlescholarauthorid dongshengwu.md:p7MeBuYAAAAJ

J. Christopher Fromme googlescholarauthorid j.christopher_fromme.md:MoIdJDcAAAAJ

Jean-Philip Piquemal googlescholarauthorid jean-philippiquemal.md:z0cOrb0AAAAJ

Kenneth M. Merz Jr. googlescholarauthorid kennethm.merzjr..md:vhpR_AwAAAAJ

John C. Faver googlescholarauthorid johnc._faver.md:ngoqSMgAAAAJ

Ray Luo googlescholarauthorid rayluo.md:CONRN6AAAAAJ

Michael J. Schnieders googlescholarauthorid michaelj._schnieders.md:sXWbF2sAAAAJ

Liaoran Cao googlescholarauthorid liaorancao.md:BXi84Z8AAAAJ

Arjan van der Vaart googlescholarauthorid arjanvandervaart.md:VdJU2EYAAAAJ

Jin Wang googlescholarauthorid jinwang.md:DsmlgfcAAAAJ

Rebecca Terns, Ph.D. googlescholarauthorid rebeccaterns,_ph.d..md:EQ4EHpgAAAAJ

Michael Terns googlescholarauthorid michaelterns.md:CBklIWkAAAAJ

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Xiaolin Cheng googlescholarauthorid xiaolincheng.md:lh1C5dkAAAAJ

Wikipedia

Yang Wei

Summary: Yang Wei or Wei Yang may refer to:

Shang Yang or Wei Yang (Chinese: 衞鞅; c. 390–338 BCE), ancient Chinese philosopher and politician Yang Longyan (897–920) or Yang Wei (楊渭), King of Wu of the Five Dynasties and Ten Kingdoms Period Yang Wei (engineer) (杨卫, born 1954), president of Zhejiang University Yang Wei (aircraft designer) (杨伟, born 1963), Chinese aircraft designer Wei Yang (biologist) (杨薇, born 1963), Chinese-American biologist Wei Yang (urban designer) (born 1974), Chinese-British urban designer Yang Wei (badminton) (杨维, born 1979), Chinese badminton player Yang Wei (gymnast) (杨威, born 1980), Chinese gymnast Chinese cruiser Yangwei, a late Qing-dynasty warship with the Beiyang Fleet

URL: https://en.wikipedia.org/wiki/Yang_Wei

Page ID: 935485

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Content: Yang Wei or Wei Yang may refer to:

Shang Yang or Wei Yang (Chinese: 衞鞅; c. 390–338 BCE), ancient Chinese philosopher and politician Yang Longyan (897–920) or Yang Wei (楊渭), King of Wu of the Five Dynasties and Ten Kingdoms Period Yang Wei (engineer) (杨卫, born 1954), president of Zhejiang University Yang Wei (aircraft designer) (杨伟, born 1963), Chinese aircraft designer Wei Yang (biologist) (杨薇, born 1963), Chinese-American biologist Wei Yang (urban designer) (born 1974), Chinese-British urban designer Yang Wei (badminton) (杨维, born 1979), Chinese badminton player Yang Wei (gymnast) (杨威, born 1980), Chinese gymnast Chinese cruiser Yangwei, a late Qing-dynasty warship with the Beiyang Fleet