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SpringerLink电子期刊(7)
NATURE电子期刊(2)
ACS电子期刊(31)
ProQuest学位论文(2)
Elsevier电子期刊(15)
在“
ACS电子期刊
”中,
命中:
31
条,耗时:小于0.01 秒
在所有数据库中总计命中:
57
条
1.
Moving Beyond Active-Site Detection: MixMD Applied to Allosteric Systems
作者:
Phani Ghanakota
;
Heather
A.
Carlson
刊名:Journal of Physical Chemistry B
出版年:2016
2.
CSAR 2014: A Benchmark Exercise Using Unpublished Data from Pharma
作者:
Heather
A.
Carlson
;
Richard D. Smith
;
Kelly L. Damm-Ganamet
;
Jeanne A. Stuckey
;
Aqeel Ahmed
;
Maire A. Convery
;
Donald O. Somers
;
Michael Kranz
;
Patricia A. Elkins
;
Guanglei Cui
;
Catherine E. Peishoff
;
Millard H. Lambert
;
James B. Dunbar Jr.
刊名:Journal of Chemical Information and Modeling
出版年:2016
3.
CSAR Benchmark Exercise 2013: Evaluation of Results from a Combined Computational Protein Design, Docking, and Scoring/Ranking Challenge
作者:
Richard D. Smith
;
Kelly L. Damm-Ganamet
;
James B. Dunbar Jr.
;
Aqeel Ahmed
;
Krishnapriya Chinnaswamy
;
James E. Delproposto
;
Ginger M. Kubish
;
Christine E. Tinberg
;
Sagar D. Khare
;
Jiayi Dou
;
Lindsey Doyle
;
Jeanne A. Stuckey
;
David Baker
;
Heather
A.
Carlson
刊名:Journal of Chemical Information and Modeling
出版年:2016
4.
Driving Structure-Based Drug Discovery through Cosolvent Molecular Dynamics
作者:
Phani Ghanakota
;
Heather
A.
Carlson
刊名:Journal of Medicinal Chemistry
出版年:2016
5.
Lessons Learned over Four Benchmark Exercises from the Community Structure–Activity Resource
作者:
Heather
A.
Carlson
刊名:Journal of Chemical Information and Modeling
出版年:2016
6.
Substrate-Competitive Activity-Based Profiling of Ester Prodrug Activating Enzymes
作者:
Hao Xu
;
Jaimeen D. Majmudar
;
Dahvid Davda
;
Phani Ghanakota
;
Ki H. Kim
;
Heather
A.
Carlson
;
Hollis D. Showalter
;
Brent R. Martin
;
Gordon L. Amidon
刊名:Molecular Pharmaceutics
出版年:2015
7.
An Allosteric Modulator of HIV-1 Protease Shows Equipotent Inhibition of Wild-Type and Drug-Resistant Proteases
作者:
Peter M.-U. Ung
;
James B. Dunbar
;
Jr.
;
Jason E. Gestwicki
;
Heather
A.
Carlson
刊名:Journal of Medicinal Chemistry
出版年:2014
8.
Parameter Choice Matters: Validating Probe Parameters for Use in Mixed-Solvent Simulations
作者:
Katrina W. Lexa
;
Garrett B. Goh
;
Heather
A.
Carlson
刊名:Journal of Chemical Information and Modeling
出版年:2014
9.
CSAR Benchmark Exercise 2011鈥?012: Evaluation of Results from Docking and Relative Ranking of Blinded Congeneric Series
作者:
Kelly L. Damm-Ganamet
;
Richard D. Smith
;
James B. Dunbar
;
Jr.
;
Jeanne A. Stuckey
;
Heather
A.
Carlson
刊名:Journal of Chemical Information and Modeling
出版年:2013
10.
CSAR Data Set Release 2012: Ligands, Affinities, Complexes, and Docking Decoys
作者:
James B. Dunbar
;
Jr.
;
Richard D. Smith
;
Kelly L. Damm-Ganamet
;
Aqeel Ahmed
;
Emilio Xavier Esposito
;
James Delproposto
;
Krishnapriya Chinnaswamy
;
You-Na Kang
;
Ginger Kubish
;
Jason E. Gestwicki
;
Jeanne A. Stuckey
;
Heather
A.
Carlson
刊名:Journal of Chemical Information and Modeling
出版年:2013
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