W. Michael Brown
W. Michael Brown
Intel Corporation
Verified email at unmalumni.com - Homepage
Cited by
Cited by
Implementing molecular dynamics on hybrid high performance computers–short range forces
WM Brown, P Wang, SJ Plimpton, AN Tharrington
Computer Physics Communications 182 (4), 898-911, 2011
OpenOrd: an open-source toolbox for large graph layout
S Martin, WM Brown, R Klavans, KW Boyack
IS&T/SPIE Electronic Imaging, 786806-786806-11, 2011
Implementing molecular dynamics on hybrid high performance computers–Particle–particle particle-mesh
WM Brown, A Kohlmeyer, SJ Plimpton, AN Tharrington
Computer Physics Communications 183 (3), 449-459, 2012
Metabolism of the 2-oxoaldehyde methylglyoxal by aldose reductase and by glyoxalase-I: roles for glutathione in both enzymes and implications for diabetic complications
DL Vander Jagt, RK Hassebrook, LA Hunsaker, WM Brown, RE Royer
Chemico-biological interactions 130, 549-562, 2001
Comparative structural analysis and kinetic properties of lactate dehydrogenases from the four species of human malarial parasites
WM Brown, CA Yowell, A Hoard, TA Vander Jagt, LA Hunsaker, LM Deck, ...
Biochemistry 43 (20), 6219-6229, 2004
Implementing molecular dynamics on hybrid high performance computers—Three-body potentials
WM Brown, M Yamada
Computer Physics Communications 184 (12), 2785-2793, 2013
Algorithmic dimensionality reduction for molecular structure analysis
WM Brown, S Martin, SN Pollock, EA Coutsias, JP Watson
The Journal of chemical physics 129 (6), 064118, 2008
New insights into the dynamics and morphology of P3HT: PCBM active layers in bulk heterojunctions
JMY Carrillo, R Kumar, M Goswami, BG Sumpter, WM Brown
Physical Chemistry Chemical Physics 15 (41), 17873-17882, 2013
Optimal neuronal tuning for finite stimulus spaces
WM Brown, A Bäcker
Neural computation 18 (7), 1511-1526, 2006
Liquid crystal nanodroplets in solution
WM Brown, MK Petersen, SJ Plimpton, GS Grest
The Journal of chemical physics 130 (4), 044901, 2009
Designing novel polymers with targeted properties using the signature molecular descriptor
WM Brown, S Martin, MD Rintoul, JL Faulon
Journal of chemical information and modeling 46 (2), 826-835, 2006
Poly (3-hexylthiophene) Molecular Bottlebrushes via Ring-Opening Metathesis Polymerization: Macromolecular Architecture Enhanced Aggregation
S Ahn, DL Pickel, WM Kochemba, J Chen, D Uhrig, JP Hinestrosa, ...
ACS Macro Letters 2 (8), 761-765, 2013
17-β-Hydroxysteroid dehydrogenase type 1: computational design of active site inhibitors targeted to the Rossmann fold
WM Brown, LE Metzger, JP Barlow, LA Hunsaker, LM Deck, RE Royer, ...
Chemico-biological interactions 143, 481-491, 2003
DrL: Distributed Recursive (Graph) Layout.
SB Martin, WM Brown, R Klavans, KW Boyack
Journal of Graph Algorithms and Applications, 2008
Accelerated application development: The ORNL Titan experience
W Joubert, R Archibald, M Berrill, WM Brown, M Eisenbach, R Grout, ...
Computers & Electrical Engineering 46, 123-138, 2015
Reverse engineering chemical structures from molecular descriptors: how many solutions?
JL Faulon, WM Brown, S Martin
Journal of computer-aided molecular design 19 (9), 637-650, 2005
Optimizing legacy molecular dynamics software with directive-based offload
WM Brown, JMY Carrillo, N Gavhane, FM Thakkar, SJ Plimpton
Computer Physics Communications 195, 95-101, 2015
Explicit Solvent Simulations of Friction between Brush Layers of Charged and Neutral Bottle-Brush Macromolecules
JMY Carrillo, WM Brown, AV Dobrynin
Macromolecules 45 (21), 8880-8891, 2012
Inhibition of yeast lipase (CRL1) and cholesterol esterase (CRL3) by 6-chloro-2-pyrones: comparison with porcine cholesterol esterase
MS Hatch, WM Brown, JA Deck, LA Hunsaker, LM Deck, DL Vander Jagt
Biochimica et Biophysica Acta (BBA)-Protein Structure and Molecular …, 2002
Rupture mechanism of liquid crystal thin films realized by large-scale molecular simulations
TD Nguyen, JMY Carrillo, MA Matheson, WM Brown
Nanoscale 6 (6), 3083-3096, 2014
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