受强制性开放获取政策约束的文章 - Megan L. Peach了解详情
无法在其他位置公开访问的文章：2 篇
Molecular docking and structure-based virtual screening
C Liao, ML Peach, R Yao, MC Nicklaus
In Silico Drug Discovery & Design, 6-20, 2013
强制性开放获取政策： US National Institutes of Health
Enigmazole Phosphomacrolides from the Marine Sponge Cinachyrella enigmatica
K Takada, N Oku, ML Peach, TT Ransom, CJ Henrich, KR Gustafson
The Journal of Organic Chemistry 88 (15), 10996-11002, 2023
强制性开放获取政策： US National Institutes of Health
可在其他位置公开访问的文章：34 篇
QSAR modeling of imbalanced high-throughput screening data in PubChem
AV Zakharov, ML Peach, M Sitzmann, MC Nicklaus
Journal of chemical information and modeling 54 (3), 705-712, 2014
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Isolation, structural elucidation, and absolute stereochemistry of enigmazole A, a cytotoxic phosphomacrolide from the Papua New Guinea marine sponge Cinachyrella enigmatica
N Oku, K Takada, RW Fuller, JA Wilson, ML Peach, LK Pannell, ...
Journal of the American Chemical Society 132 (30), 10278-10285, 2010
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Wealth of opportunity-the C1 domain as a target for drug development
PM Blumberg, N Kedei, NE Lewin, D Yang, G Czifra, Y Pu, ML Peach, ...
Current drug targets 9 (8), 641-652, 2008
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Directed discovery of agents targeting the Met tyrosine kinase domain by virtual screening
ML Peach, N Tan, SJ Choyke, A Giubellino, G Athauda, TR Burke Jr, ...
Journal of medicinal chemistry 52 (4), 943-951, 2009
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PDB ligand conformational energies calculated quantum-mechanically
M Sitzmann, IE Weidlich, IV Filippov, C Liao, ML Peach, WD Ihlenfeldt, ...
Journal of chemical information and modeling 52 (3), 739-756, 2012
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Combining docking with pharmacophore filtering for improved virtual screening
ML Peach, MC Nicklaus
Journal of cheminformatics 1, 6, 2009
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Computational tools and resources for metabolism-related property predictions. 1. Overview of publicly available (free and commercial) databases and software
ML Peach, AV Zakharov, R Liu, A Pugliese, G Tawa, A Wallqvist, ...
Future medicinal chemistry 4 (15), 1907-1932, 2012
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Molecular modeling, total synthesis, and biological evaluations of C9‐deoxy bryostatin 1
GE Keck, YB Poudel, A Rudra, JC Stephens, N Kedei, NE Lewin, ...
Angewandte Chemie International Edition 49 (27), 4580-4584, 2010
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A new approach to radial basis function approximation and its application to QSAR
AV Zakharov, ML Peach, M Sitzmann, MC Nicklaus
Journal of Chemical Information and Modeling 54 (3), 713-719, 2014
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SAVI, in silico generation of billions of easily synthesizable compounds through expert-system type rules
H Patel, WD Ihlenfeldt, PN Judson, YS Moroz, Y Pevzner, ML Peach, ...
Scientific data 7 (1), 384, 2020
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Tautomerism of warfarin: combined chemoinformatics, quantum chemical, and NMR investigation
L Guasch, ML Peach, MC Nicklaus
The Journal of organic chemistry 80 (20), 9900-9909, 2015
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Conformationally constrained analogues of diacylglycerol. 29. Cells sort diacylglycerol-lactone chemical zip codes to produce diverse and selective biological activities
D Duan, DM Sigano, JA Kelley, CC Lai, NE Lewin, N Kedei, ML Peach, ...
Journal of medicinal chemistry 51 (17), 5198-5220, 2008
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Experimental and chemoinformatics study of tautomerism in a database of commercially available screening samples
L Guasch, W Yapamudiyansel, ML Peach, JA Kelley, JJ Barchi Jr, ...
Journal of Chemical Information and Modeling 56 (11), 2149-2161, 2016
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Conformational energy range of ligands in protein crystal structures: the difficult quest for accurate understanding
ML Peach, RE Cachau, MC Nicklaus
Journal of Molecular Recognition 30 (8), e2618, 2017
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Synthesis of seco-B-Ring Bryostatin Analogue WN-1 via C–C Bond-Forming Hydrogenation: Critical Contribution of the B-Ring in Determining Bryostatin-like and …
IP Andrews, JM Ketcham, PM Blumberg, N Kedei, NE Lewin, ML Peach, ...
Journal of the American Chemical Society 136 (38), 13209-13216, 2014
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Computational tools and resources for metabolism-related property predictions. 2. Application to prediction of half-life time in human liver microsomes
AV Zakharov, ML Peach, M Sitzmann, IV Filippov, HJ McCartney, ...
Future medicinal chemistry 4 (15), 1933-1944, 2012
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Synthesis of a des-B-Ring Bryostatin Analogue Leads to an Unexpected Ring Expansion of the Bryolactone Core
MB Kraft, YB Poudel, N Kedei, NE Lewin, ML Peach, PM Blumberg, ...
Journal of the American Chemical Society 136 (38), 13202-13208, 2014
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Molecular basis for failure of “atypical” C1 domain of Vav1 to bind diacylglycerol/phorbol ester
T Geczy, ML Peach, S El Kazzouli, DM Sigano, JH Kang, CJ Valle, ...
Journal of Biological Chemistry 287 (16), 13137-13158, 2012
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