Automated Construction and Optimization Combined with Machine Learning to Generate Pt(II) Methane C–H Activation Transition States
Author:
Funder
u.s. department of energy
Publisher
Springer Science and Business Media LLC
Subject
General Chemistry,Catalysis
Link
https://link.springer.com/content/pdf/10.1007/s11244-021-01506-0.pdf
Reference100 articles.
1. Bergman RG (2007) C–H activation. Nature 446:391–393
2. Labinger JA, Bercaw JE (2002) Understanding and exploiting C–H bond activation. Nature 417:507–514
3. Shilov AE, Shul’pin GB (1997) Activation of C− H bonds by metal complexes. Chem Rev 97:2879–2932
4. Stahl SS, Labinger JA, Bercaw JE (1998) Homogeneous oxidation of alkanes by electrophilic late transition metals. Angew Chem Int Ed 37:2180–2192
5. Sen A (1998) Catalytic functionalization of carbon-hydrogen and carbon-carbon bonds in protic media. Acc Chem Res 31:550–557
Cited by 13 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. Learning Design Rules for Catalysts Through Computational Chemistry and Machine Learning;Exploring Chemical Concepts Through Theory and Computation;2024-05-17
2. Directional multiobjective optimization of metal complexes at the billion-system scale;Nature Computational Science;2024-03-29
3. Automated Transition Metal Catalysts Discovery and Optimisation with AI and Machine Learning;ChemCatChem;2024-02-20
4. On Accelerating Substrate Optimization Using Computational Gibbs Energy Barriers: A Numerical Consideration Utilizing a Computational Data Set;ACS Omega;2024-01-29
5. Paving the road towards automated homogeneous catalyst design;ChemPlusChem;2024-01-26
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