Application of molecular dynamics calculations in the prediction of dynamical molecular properties
Author:
Publisher
Elsevier BV
Subject
Geochemistry and Petrology
Reference25 articles.
1. Allen, M. P. and Tildesley, D. J. (1987) Computer Simulation of Liquids. Clarendon Press, Oxford
2. Molecular mechanics (MM3) calculations on conjugated hydrocarbons;Allinger;Journal of Computational Chemistry,1990
3. RATTLE: a “velocity” version of the SHAKE algorithm for molecular dynamics calculations;Andersen;Journal of Computational Physics,1983
4. Molecular dynamics with coupling to an external bath;Berendsen;Journal of Chemistry and Physics,1984
5. Use of molecular modelling as a tool to evaluate thermodynamic stability of alkylated polycyclic aromatic hydrocarbons;Budzinski;Energy and Fuels,1993
Cited by 34 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. Oil origin and secondary migration pathway in the Bonan sag, Bohai Bay Basin, China;Marine and Petroleum Geology;2020-12
2. Fractionation of alkylated carbazoles in petroleum during subsurface migration: Evidence from molecular simulation and application in sandstone reservoirs;Journal of Petroleum Science and Engineering;2020-08
3. Oil–source-rock correlation of the Lower Paleozoic petroleum system in the Baltic Basin (northern Europe);AAPG Bulletin;2017-12
4. Influence of biodegradation on carbazole and benzocarbazole distributions in oils from the Bongor Basin, Chad;Organic Geochemistry;2016-10
5. Regional petroleum alteration trends in Barents Sea oils and condensates as a clue to migration regimes and processes;AAPG Bulletin;2016-02
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