Semi-Empirical Born–Oppenheimer Molecular Dynamics (SEBOMD) within the Amber Biomolecular Package
Author:
Affiliation:
1. Université de Lorraine, CNRS, LPCT, F-54000 Nancy, France
2. Department of Chemistry, Middle East Technical University, 06800, Ankara, Turkey
3. Department of Chemistry, University of North Texas, Denton, Texas 76201, United States
Funder
T?rkiye Bilimsel ve Teknolojik Arastirma Kurumu
Ambassade de France ? Ankara
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.8b00605
Reference87 articles.
1. Pretransfer Editing in Threonyl-tRNA Synthetase: Roles of Differential Solvent Accessibility and Intermediate Stabilization
2. Computational insights into substrate binding and catalytic mechanism of the glutaminase domain of glucosamine-6-phosphate synthase (GlmS)
3. Why Does Asn71 Deamidate Faster Than Asn15 in the Enzyme Triosephosphate Isomerase? Answers from Microsecond Molecular Dynamics Simulation and QM/MM Free Energy Calculations
4. ReaxFF: A Reactive Force Field for Hydrocarbons
5. ReaxFF Reactive Force Field for Molecular Dynamics Simulations of Hydrocarbon Oxidation
Cited by 7 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. Formosanin C inhibits pulmonary metastasis by targeting stearyl CoA desaturase-1;Phytomedicine;2024-07
2. Divide-and-Conquer Linear-Scaling Quantum Chemical Computations;The Journal of Physical Chemistry A;2023-01-11
3. Thermodynamic and structural analysis of graphene/polymer nanocomposites for the adsorption of azo dyes present in binary mixed;Novel Materials for Environmental Remediation Applications;2023
4. ULYSSES: An Efficient and Easy to Use Semiempirical Library for C++;Journal of Chemical Information and Modeling;2022-08-05
5. Molecular Dynamics of Oligonucleotide DNA Complexes with Phosphatidylserine;Biointerface Research in Applied Chemistry;2022-07-10
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