Статті для всіх - Jeffry MaduraДокладніше
Недоступно ніде: 3
A review of monoamine transporter-ligand interactions
K Immadisetty, J D Madura
Current computer-aided drug design 9 (4), 556-568, 2013
Мандати: US National Institutes of Health
Identifying trends in hydration behavior for modifications to the hydrophobicity of poly (n-isopropylacrylamide)
ML Galbraith, JD Madura
Journal of Molecular Graphics and Modelling 78, 168-175, 2017
Мандати: US National Science Foundation, US National Institutes of Health
Seed, Foster, Believe, Dream and Act. Capacity Building in Kenya by Novartis Global Discovery Chemistry, Seeding Labs, the International Activities Committee, and the Computers …
L Whitehead, EO Changamu, N Dudnik, P McCarren, R Chopra, RR Fazio, ...
Jobs, Collaborations, and Women Leaders in the Global Chemistry Enterprise …, 2015
Мандати: Grand Challenges, Canada
Доступно в інших місцях: 38
Global transitions of proteins explored by a multiscale hybrid methodology: application to adenylate kinase
M Gur, JD Madura, I Bahar
Biophysical journal 105 (7), 1643-1652, 2013
Мандати: US National Institutes of Health
Photonic crystal protein hydrogel sensor materials enabled by conformationally induced volume phase transition
Z Cai, LA Luck, D Punihaole, JD Madura, SA Asher
Chemical science 7 (7), 4557-4562, 2016
Мандати: US National Science Foundation
Monoamine transporter structure, function, dynamics, and drug discovery: a computational perspective
S Manepalli, CK Surratt, JD Madura, TL Nolan
The AAPS journal 14, 820-831, 2012
Мандати: US National Institutes of Health
Molecular dynamics of leucine and dopamine transporter proteins in a model cell membrane lipid bilayer
PC Gedeon, M Indarte, CK Surratt, JD Madura
Proteins: Structure, Function, and Bioinformatics 78 (4), 797-811, 2010
Мандати: US National Institutes of Health
A role for fragment-based drug design in developing novel lead compounds for central nervous system targets
MJ Wasko, KA Pellegrene, JD Madura, CK Surratt
Frontiers in neurology 6, 197, 2015
Мандати: US National Institutes of Health
Salt dependence of an α-helical peptide folding energy landscapes
K Xiong, EK Asciutto, JD Madura, SA Asher
Biochemistry 48 (45), 10818-10826, 2009
Мандати: US National Institutes of Health
Receptor-based modeling and 3D-QSAR for a quantitative production of the butyrylcholinesterase inhibitors based on genetic algorithm
R Uddin, H Yuan, PA Petukhov, MI Choudhary, JD Madura
Journal of chemical information and modeling 48 (5), 1092-1103, 2008
Мандати: US National Institutes of Health
Experimentally Restrained Molecular Dynamics Simulations for Characterizing the Open States of Cytochrome P450cam
EK Asciutto, M Dang, SS Pochapsky, JD Madura, TC Pochapsky
Biochemistry 50 (10), 1664-1671, 2011
Мандати: US National Institutes of Health
Design, synthesis, and testing of an 6-O-linked series of benzimidazole based inhibitors of CDK5/p25
P Jain, PT Flaherty, S Yi, I Chopra, G Bleasdell, J Lipay, Y Ferandin, ...
Bioorganic & medicinal chemistry 19 (1), 359-373, 2011
Мандати: US National Institutes of Health
Chemical shift tensors of cimetidine form A modeled with density functional theory calculations: implications for NMR crystallography
ST Holmes, OG Engl, MN Srnec, JD Madura, R Quinones, JK Harper, ...
The Journal of Physical Chemistry A 124 (16), 3109-3119, 2020
Мандати: US National Science Foundation, Natural Sciences and Engineering Research …
Accelerated molecular dynamics and protein conformational change: a theoretical and practical guide using a membrane embedded model neurotransmitter transporter
PC Gedeon, JR Thomas, JD Madura
Molecular modeling of proteins, 253-287, 2015
Мандати: US National Institutes of Health
Solution Structural Ensembles of Substrate-Free Cytochrome P450cam
EK Asciutto, MJ Young, J Madura, SS Pochapsky, TC Pochapsky
Biochemistry 51 (16), 3383-3393, 2012
Мандати: US National Institutes of Health
A Python Program for Solving Schrödinger’s Equation in Undergraduate Physical Chemistry
MN Srnec, S Upadhyay, JD Madura
Journal of Chemical Education 94 (6), 813-815, 2017
Мандати: US National Science Foundation
Discovery of novel selective serotonin reuptake inhibitors through development of a protein-based pharmacophore
S Manepalli, LM Geffert, CK Surratt, JD Madura
Journal of chemical information and modeling 51 (9), 2417-2426, 2011
Мандати: US National Institutes of Health
Polyglutamine fibrils: new insights into antiparallel β-sheet conformational preference and side chain structure
D Punihaole, RJ Workman, Z Hong, JD Madura, SA Asher
The Journal of Physical Chemistry B 120 (12), 3012-3026, 2016
Мандати: US National Science Foundation, US National Institutes of Health
Polymorphism and second harmonic generation in a novel diamond-like semiconductor: Li2MnSnS4
KP Devlin, AJ Glaid, JA Brant, JH Zhang, MN Srnec, DJ Clark, YS Kim, ...
Journal of Solid State Chemistry 231, 256-266, 2015
Мандати: US Department of Energy
LeuT conformational sampling utilizing accelerated molecular dynamics and principal component analysis
JR Thomas, PC Gedeon, BJ Grant, JD Madura
Biophysical journal 103 (1), L1-L3, 2012
Мандати: US National Institutes of Health
Дані про публікацію й грошову підтримку визначаються автоматично комп'ютерною програмою