Microsolvated transition state models for improved insight into chemical properties and reaction mechanisms
Author:
Publisher
Royal Society of Chemistry (RSC)
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://pubs.rsc.org/en/content/articlepdf/2012/CP/C2CP41719G
Reference119 articles.
1. Selected features of the polarizable continuum model for the representation of solvation
2. Chapter 14 Solvent Effects on Organic Reactions from QM/MM Simulations
3. Advances in Quantum and Molecular Mechanical (QM/MM) Simulations for Organic and Enzymatic Reactions
4. Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics
5. Quantum Mechanical Continuum Solvation Models
Cited by 86 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. Nickel-Catalyzed Asymmetric Hydroamination of Branched 1,3-Diene: Mechanism and Origin of Regio- and Enantioselectivities;ACS Catalysis;2024-07-26
2. The Stability of Hydrogen‐Bonded Ion‐Pair Complex Unexpectedly Increases with Increasing Solvent Polarity;Angewandte Chemie International Edition;2024-04-04
3. The Stability of Hydrogen‐Bonded Ion‐Pair Complex Unexpectedly Increases with Increasing Solvent Polarity;Angewandte Chemie;2024-04-04
4. DFT-Guided Mechanistic Insights into Chemodivergence: A Mixed Explicit–Implicit Solvent Description to Dictate the Chemoselectivity;The Journal of Physical Chemistry A;2023-11-22
5. Thermally Activated Geometrical Regioselective E→Z Isomerization‐Enabled Cascade Sequences of Conjugated Dienals: Experimental and DFT Studies;Chemistry – A European Journal;2023-10-02
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