Quantum Chemical Prediction of the Acidities of Sulfonamide Inhibitors of Carbonic Anhydrase
Author:
Affiliation:
1. School of Chemistry, The University of New South Wales, Sydney, NSW2052, Australia
2. NEUROFARBA Department, Sezione di Scienze Farmaceutiche e Nutraceutiche, University of Florence, 50019Florence, Italy
Funder
Australian Research Council
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c06358
Reference52 articles.
1. Carbonic anhydrases in metazoan model organisms: molecules, mechanisms, and physiology
2. Carbonic anhydrases: novel therapeutic applications for inhibitors and activators
3. Advances in the structural annotation of human carbonic anhydrases and impact on future drug discovery
4. Interfering with pH regulation in tumours as a therapeutic strategy
5. Selective hydrophobic pocket binding observed within the carbonic anhydrase II active site accommodate different 4-substituted-ureido-benzenesulfonamides and correlate to inhibitor potency
Cited by 3 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. State-of-the-art local correlation methods enable affordable gold standard quantum chemistry for up to hundreds of atoms;Chemical Science;2024
2. High-Level Quantum Chemical Prediction of C–F Bond Dissociation Energies of Perfluoroalkyl Substances;The Journal of Physical Chemistry A;2023-09-18
3. MM/GBSA prediction of relative binding affinities of carbonic anhydrase inhibitors: effect of atomic charges and comparison with Autodock4Zn;Journal of Computer-Aided Molecular Design;2023-03-17
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