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1 . Academic Journal
Design, synthesis and biological evaluation of renin inhibitors guided by simulated annealing of chemical potential simulations
저자
by
Cloudsdale, Ian S.
;
Dickson, John K., Jr.
;
Barta, Thomas E.
;
Grella, Brian S.
;
Smith, Emilie D.
, et al.
소스
In
Bioorganic & Medicinal Chemistry
1 August 2017 25(15):3947-3963
Full Text (ScienceDirect)
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7 . Academic Journal
Binding Hot Spots and Amantadine Orientation in the Influenza A Virus M2 Proton Channel
저자
by
Chuang, Gwo-Yu
;
Kozakov, Dima
;
Brenke, Ryan
;
Beglov, Dmitri
;
Guarnieri, Frank
, et al.
소스
In
Biophysical Journal
15 November 2009 97(10):2846-2853
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Full Text (ScienceDirect O/A)
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7 . Academic Journal
Use of a Molecular Switch Probe to Activate or Inhibit GIRK1 Heteromers In Silico Reveals a Novel Gating Mechanism.
저자
by
Gazgalis, Dimitrios
;
Cantwell, Lucas
;
Xu, Yu
;
Thakur, Ganesh A.
;
Cui, Meng
, et al.
소스
International Journal of Molecular Sciences
. Sep2022, Vol. 23 Issue 18, pN.PAG-N.PAG. 23p.
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7 . Academic Journal
Targeting antigen-specific T cells by genetically engineered antigen presenting cells: A strategy for specific immunotherapy of autoimmune disease
저자
by
Wu, Jian-Ming
;
Wu, Bo
;
Guarnieri, Frank
;
August, J.Thomas
;
Drachman, Daniel B.
.
소스
In
Journal of Neuroimmunology
2000 106(1):145-153
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7 . Academic Journal
Fragment-based design of small molecule PCSK9 inhibitors using simulated annealing of chemical potential simulations.
저자
by
Guarnieri, Frank
;
Kulp, John L.
;
Kulp III, John L.
;
Cloudsdale, Ian S.
.
소스
PLoS ONE
. 12/5/2019, Vol. 14 Issue 12, p1-26. 26p.
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6 . Academic Journal
Discovery of a novel class of non-ATP site DFG-out state p38 inhibitors utilizing computationally assisted virtual fragment-based drug design (vFBDD)
저자
by
Moffett, Kristofer
;
Konteatis, Zenon
;
Nguyen, Duyan
;
Shetty, Rupa
;
Ludington, Jennifer
, et al.
소스
In
Bioorganic & Medicinal Chemistry Letters
2011 21(23):7155-7165
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7 . Academic Journal
Hot-spot identification on a broad class of proteins and RNA suggest unifying principles of molecular recognition.
저자
by
IIIKulp, John L.
;
Cloudsdale, Ian S.
;
JrKulp, John L.
;
Guarnieri, Frank
.
소스
PLoS ONE
. 8/24/2017, Vol. 12 Issue 8, p1-34. 34p.
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6 . Book
Designing an Orally Available Nontoxic p38 Inhibitor with a Fragment-Based Strategy.
저자
by
Guarnieri, Frank
.
소스
Fragment-Based Methods in Drug Discovery; 2015, p211-226, 16p
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3 . Book
Designing a Small Molecule Erythropoietin Mimetic.
저자
by
Guarnieri, Frank
.
소스
Fragment-Based Methods in Drug Discovery; 2015, p185-210, 26p
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3 . Academic Journal
A fragment-based approach to the SAMPL3 Challenge.
저자
by
Kulp, John
;
Blumenthal, Seth
;
Wang, Qiang
;
Bryan, Richard
;
Guarnieri, Frank
.
소스
Journal of Computer-Aided Molecular Design
. May2012, Vol. 26 Issue 5, p583-594. 12p. 3 Color Photographs, 4 Diagrams, 1 Chart, 1 Graph.
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