MARS: Computing Three-Dimensional Alignments for Multiple Ligands Using Pairwise Similarities
Author:
Affiliation:
1. Sanofi-Aventis Deutschland GmbH, R&D LGCR/Struct., Design & Informatics, 65926 Frankfurt am Main, Germany
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/ci3000369
Reference28 articles.
1. Catalyst;Accelrys Software Inc.:San Diego, CA,92121.
2. PHASE: a new engine for pharmacophore perception, 3D QSAR model development, and 3D database screening: 1. Methodology and preliminary results
3. PHASE: A Novel Approach to Pharmacophore Modeling and 3D Database Searching
4. Efficient overlay of small organic molecules using 3D pharmacophores
5. LigandScout: 3-D Pharmacophores Derived from Protein-Bound Ligands and Their Use as Virtual Screening Filters
Cited by 12 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. Small molecule superposition: A comprehensive overview on pose scoring of the latest methods;WIREs Computational Molecular Science;2022-10-11
2. Impact of Different Automated Binding Pose Generation Approaches on Relative Binding Free Energy Simulations;Journal of Chemical Information and Modeling;2020-01-28
3. A universal algorithm for finding the shortest distance between systems of points;Acta Crystallographica Section A Foundations and Advances;2019-10-07
4. Continuous molecular fields and the concept of molecular co-fields in structure–activity studies;Future Medicinal Chemistry;2019-10
5. Polypharmacology by Design: A Medicinal Chemist’s Perspective on Multitargeting Compounds;Journal of Medicinal Chemistry;2018-07-23
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