Effects of Polarizable Solvent Models upon the Relative Stability of an α-Helical and a β-Hairpin Structure of an Alanine Decapeptide
Author:
Affiliation:
1. Laboratory of Physical Chemistry, Swiss Federal Institute of Technology, ETH, 8093 Zürich, Zürich, Switzerland
Funder
European Research Council
Schweizerische Nationalfonds zur Förderung der Wissenschaftlichen Forschung
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.5b00210
Reference33 articles.
1. A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules
2. Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
3. All-Atom Empirical Potential for Molecular Modeling and Dynamics Studies of Proteins
4. New Interaction Parameters for Charged Amino Acid Side Chains in the GROMOS Force Field
5. Polarizable Force Fields: History, Test Cases, and Prospects
Cited by 9 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. Methods for Classical-Mechanical Molecular Simulation in Chemistry: Achievements, Limitations, Perspectives;Journal of Chemical Information and Modeling;2024-08-13
2. Transferability of the Electrostatic Parameters of the Polarizable Gaussian Multipole Model;Journal of Chemical Theory and Computation;2023-01-25
3. Energetics and J-coupling constants for Ala, Gly, and Val peptides demonstrated using ABEEM polarizable force field in vacuo and an aqueous solution;Physical Chemistry Chemical Physics;2022
4. Polarizable and non-polarizable force fields: Protein folding, unfolding, and misfolding;The Journal of Chemical Physics;2020-11-14
5. Accurate Prediction of Protein NMR Spin Relaxation by Means of Polarizable Force Fields. Application to Strongly Anisotropic Rotational Diffusion;The Journal of Physical Chemistry B;2020-06-05
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