المؤلفون: Seritan, Stefan, Bannwarth, Christoph, Fales, Bryan S., Hohenstein, Edward G., Isborn, Christine M., Kokkila‐Schumacher, Sara I. L., Li, Xin, Liu, Fang, Luehr, Nathan, Snyder, James W., Song, Chenchen, Titov, Alexey V., Ufimtsev, Ivan S., Wang, Lee‐Ping, Martínez, Todd J.

المصدر: WIREs: Computational Molecular Science; Mar/Apr2021, Vol. 11 Issue 2, p1-16, 16p

المؤلفون: Wang, Lee-Ping, McKiernan, Keri A., Gomes, Joseph, Beauchamp, Kyle A., Head-Gordon, Teresa, Rice, Julia E., Swope, William C., Martínez, Todd J., Pande, Vijay S.

المساهمون: U.S. Department of Health and Human Services, Starr Foundation, National Science Foundation

المصدر: The Journal of Physical Chemistry B ; volume 121, issue 16, page 4023-4039 ; ISSN 1520-6106 1520-5207

الإتاحة: https://doi.org/10.1021/acs.jpcb.7b02320Test

المؤلفون: Huang, Jing, Mei, Ye, König, Gerhard, Simmonett, Andrew C., Pickard, Frank C., Wu, Qin, Wang, Lee-Ping, MacKerell, Alexander D., Brooks, Bernard R., Shao, Yihan

المساهمون: Small Business Innovative Research and Small Business Technology Transfer, National Institute of General Medical Sciences

المصدر: Journal of Chemical Theory and Computation ; volume 13, issue 2, page 679-695 ; ISSN 1549-9618 1549-9626

مصطلحات موضوعية: Physical and Theoretical Chemistry, Computer Science Applications

الإتاحة: https://doi.org/10.1021/acs.jctc.6b01125Test

المؤلفون: Wang, Chi‐Yuen, Zhu, Ai‐Yu, Liao, Xin, Manga, Michael, Wang, Lee‐Ping

المصدر: Water Resources Research; Aug2019, Vol. 55 Issue 8, p6886-6895, 10p

مصطلحات موضوعية: EARTH tides, GROUNDWATER flow, GROUNDWATER, HYDRAULICS, TIDAL power, ZONE of aeration, WATER table

المؤلفون: Wang, Lee-Ping¹, Van Voorhis, Troy¹

المصدر: Journal of Chemical Physics. 12/21/2010, Vol. 133 Issue 23, p231101. 4p. 3 Graphs.

مصطلحات موضوعية: *POTENTIAL energy surfaces, *MOLECULAR dynamics, *CONFIGURATION space, *SIMULATION methods & models, *QUANTUM theory, *ALGORITHMS, *HARTREE-Fock approximation, *MATHEMATICAL optimization

المؤلفون: Albaugh, Alex, Boateng, Henry A., Bradshaw, Richard, Demerdash, Omar N., Dziedzic, Jacek, Mao, Yuezhi, Margul, Daniel T., Swails, Jason, Zeng, Qiao, Case, David A., Eastman, Peter, Wang, Lee-Ping, Essex, Jonathan, Head-Gordon, Martin, Pande, Vijay S., Ponder, Jay W., Shao, Yihan, Skylaris, Chris, Todorov, Ilian T., Tuckerman, Mark E., Head-Gordon, Teresa

وصف الملف: text

العلاقة: https://eprints.soton.ac.uk/402287/1/JPCB_Feature_revise.pdfTest; Albaugh, Alex, Boateng, Henry A., Bradshaw, Richard, Demerdash, Omar N., Dziedzic, Jacek, Mao, Yuezhi, Margul, Daniel T., Swails, Jason, Zeng, Qiao, Case, David A., Eastman, Peter, Wang, Lee-Ping, Essex, Jonathan, Head-Gordon, Martin, Pande, Vijay S., Ponder, Jay W., Shao, Yihan, Skylaris, Chris, Todorov, Ilian T., Tuckerman, Mark E. and Head-Gordon, Teresa (2016) Advanced potential energy surfaces for molecular simulation. The Journal of Physical Chemistry B, 120 (37), 9811-9832. (doi:10.1021/acs.jpcb.6b06414 ). (PMID:27513316 )

الإتاحة: https://doi.org/10.1021/acs.jpcb.6b06414Test
https://eprints.soton.ac.uk/402287Test/
https://eprints.soton.ac.uk/402287/1/JPCB_Feature_revise.pdfTest

المؤلفون: Khedri, Zahra, Xiao, An, Yu, Hai, Landig, Corinna Susanne, Li, Wanqing, Diaz, Sandra, Wasik, Brian R., Parrish, Colin R., Wang, Lee-Ping, Varki, Ajit, Chen, Xi

المساهمون: National Institute of Child Health and Human Development, National Institute of General Medical Sciences

المصدر: ACS Chemical Biology ; volume 12, issue 1, page 214-224 ; ISSN 1554-8929 1554-8937

الإتاحة: https://doi.org/10.1021/acschembio.6b00928Test

المؤلفون: Wang, Lee-Ping, McGibbon, Robert T., Pande, Vijay S., Martinez, Todd J.

المساهمون: Basic Energy Sciences, Office of Naval Research, U.S. Department of Defense

المصدر: Journal of Chemical Theory and Computation ; volume 12, issue 2, page 638-649 ; ISSN 1549-9618 1549-9626

الإتاحة: https://doi.org/10.1021/acs.jctc.5b00830Test

المؤلفون: McKiernan, Keri A., Wang, Lee-Ping, Pande, Vijay S.

المساهمون: Division of Molecular and Cellular Biosciences, National Institute of General Medical Sciences

المصدر: Journal of Chemical Theory and Computation ; volume 12, issue 12, page 5960-5967 ; ISSN 1549-9618 1549-9626

مصطلحات موضوعية: Physical and Theoretical Chemistry, Computer Science Applications

الإتاحة: https://doi.org/10.1021/acs.jctc.6b00801Test

المؤلفون: Wang, Lee-Ping, Song, Chenchen

المساهمون: Stanford University, Advanced Cyberinfrastructure, University of California, Davis, Walt Disney Company

المصدر: The Journal of Chemical Physics ; volume 144, issue 21 ; ISSN 0021-9606 1089-7690

الإتاحة: https://doi.org/10.1063/1.4952956Test