Computing free energy hypersurfaces for anisotropic intermolecular associations
Author:
Publisher
Wiley
Subject
Computational Mathematics,General Chemistry
Link
http://onlinelibrary.wiley.com/wol1/doi/10.1002/jcc.21317/fullpdf
Reference56 articles.
1. Orientational correlation function for molecular liquids: The case of liquid water
2. Structure in liquid water: A study of spatial distribution functions
3. “Tetrahedrality” and the Relationship between Collective Structure and Radial Distribution Functions in Liquid Water
4. How effective for fold recognition is a potential of mean force that includes relative orientations between contacting residues in proteins?
5. Orientation-dependent coarse-grained potentials derived by statistical analysis of molecular structural databases
Cited by 15 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. Enzyme Reaction Dynamics From Adaptive Reaction Coordinate Forces;Comprehensive Computational Chemistry;2024
2. Molecular mechanisms from reaction coordinate graph enabled multidimensional free energies illustrated on water dimer hydrogen bonding;Journal of Computational Chemistry;2022-08-22
3. Evaluating AM1/d-CB1 for Chemical Glycobiology QM/MM Simulations;Journal of Chemical Theory and Computation;2014-09-18
4. PNP Diminishes Guanosine Glycosidic Bond Strength Through Restrictive Ring Pucker as a Precursor to Phosphorylation;The Journal of Physical Chemistry B;2013-05-10
5. Multidimensional free energy volumes offer unique insights into reaction mechanisms, molecular conformation and association;Physical Chemistry Chemical Physics;2012
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3