Automated Design of Realistic Organometallic Molecules from Fragments
Author:
Affiliation:
1. Department of Chemistry, University of Bergen, Allégaten 41, N-5007 Bergen, Norway
2. Department of Chemistry, Norwegian University of Science and Technology, N-7491 Trondheim, Norway
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/ci4007497
Reference86 articles.
1. Computer-based de novo design of drug-like molecules
2. An Evolutionary Algorithm for de Novo Optimization of Functional Transition Metal Compounds
3. In Silico Design in Homogeneous Catalysis Using Descriptor Modelling
4. Predictive modeling in homogeneous catalysis: a tutorial
5. De Novo Structure-Based Design of Bis-amidoxime Uranophiles
Cited by 37 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. Deep learning in two-dimensional materials: Characterization, prediction, and design;Frontiers of Physics;2024-04-16
2. Paving the road towards automated homogeneous catalyst design;ChemPlusChem;2024-01-26
3. Automated de Novo Design of Olefin Metathesis Catalysts: Computational and Experimental Analysis of a Simple Thermodynamic Design Criterion;Journal of Chemical Information and Modeling;2024-01-10
4. Automated approaches, reaction parameterisation, and data science in organometallic chemistry and catalysis: towards improving synthetic chemistry and accelerating mechanistic understanding;Digital Discovery;2024
5. %VBur index and steric maps: from predictive catalysis to machine learning;Chemical Society Reviews;2024
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