Calculation of chemical shift anisotropy in proteins
Author:
Publisher
Springer Science and Business Media LLC
Subject
Spectroscopy,Biochemistry
Link
http://link.springer.com/content/pdf/10.1007/s10858-011-9556-7.pdf
Reference50 articles.
1. Becke AD (1993) A new mixing of Hartree-Fock and local density-functional theories. J Chem Phys 98:1372–1377
2. Bim J, Poon A, Mao Y, Ramamoorthy A (2004) Ab initio study of C-13 alpha chemical shift anisotropy tensors in peptides. J Am Chem Soc 126:8529–8534
3. Brender JR, Taylor DM, Ramamoorthy A (2001) Orientation of amide-nitrogen-15 chemical shift tensors in peptides: a quantum chemical study. J Am Chem Soc 123:914–922
4. Burton RA, Tjandra N (2007) Residue-specific 13C CSA tensor principal components for ubiquitin: correlation between tensor components and hydrogen bonding. J Am Chem Soc 129:1321–1326
5. Cai L, Fushman D, Kosov D (2009) Density functional calculations of chemical shielding of backbone N-15 in helical residues of protein G. J Biomol NMR 45:245–253
Cited by 43 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. High-efficiency low-power 13C-15N cross polarization in MAS NMR;Journal of Magnetic Resonance;2024-04
2. Molecular mechanisms and evolutionary robustness of a color switch in proteorhodopsins;Science Advances;2024-01-26
3. Dynamic Coupling of Tyrosine 185 with the Bacteriorhodopsin Photocycle, as Revealed by Chemical Shifts, Assisted AF-QM/MM Calculations and Molecular Dynamic Simulations;International Journal of Molecular Sciences;2021-12-18
4. Using quantum chemistry to estimate chemical shifts in biomolecules;Biophysical Chemistry;2020-12
5. Polarizable continuum models provide an effective electrostatic embedding model for fragment‐based chemical shift prediction in challenging systems;Journal of Computational Chemistry;2020-08-04
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