Bayesian uncertainty quantification and propagation in molecular dynamics simulations: A high performance computing framework
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.4757266
Reference76 articles.
1. Algorithmic Challenges in Computational Molecular Biophysics
2. MOLECULAR DYNAMICS SIMULATIONS OF BIOMOLECULES: Long-Range Electrostatic Effects
3. Wetting and Molecular Dynamics Simulations of Simple Liquids
4. Atomic-Level Characterization of the Structural Dynamics of Proteins
5. Systematic Validation of Protein Force Fields against Experimental Data
Cited by 152 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. Validated respiratory drug deposition predictions from 2D and 3D medical images with statistical shape models and convolutional neural networks;PLOS ONE;2024-01-26
2. Energetics of acid catalyzed biomass reactions: how and why does the solvent model matter?;Reaction Chemistry & Engineering;2024
3. A Markov chain Monte Carlo-based Bayesian framework for system identification and uncertainty estimation of full-scale structures;Engineering Structures;2023-11
4. Experimental design and data prediction by Bayesian statistics for adsorption of tetracycline in a GAC fixed-bed column;Separation and Purification Technology;2023-08
5. A review of high performance computing applications in high-speed rail systems;High-speed Railway;2023-06
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