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douglas j baxter
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ISiCLE: a quantum chemistry pipeline for establishing in silico collision cross section libraries
SM Colby, DG Thomas, JR Nuñez, DJ Baxter, KR Glaesemann, JM Brown, ...
Analytical chemistry 91 (7), 4346-4356, 2019
912019
ScalaBLAST 2.0: rapid and robust BLAST calculations on multiprocessor systems
CS Oehmen, DJ Baxter
Bioinformatics 29 (6), 797-798, 2013
822013
Comparison of probability and likelihood models for peptide identification from tandem mass spectrometry data
WR Cannon, KH Jarman, BJM Webb-Robertson, DJ Baxter, CS Oehmen, ...
Journal of proteome research 4 (5), 1687-1698, 2005
392005
MapReduce implementation of a hybrid spectral library-database search method for large-scale peptide identification
A Kalyanaraman, WR Cannon, B Latt, DJ Baxter
Bioinformatics 27 (21), 3072-3073, 2011
322011
Large improvements in MS/MS-based peptide identification rates using a hybrid analysis
WR Cannon, MM Rawlins, DJ Baxter, SJ Callister, MS Lipton, DA Bryant
Journal of proteome research 10 (5), 2306-2317, 2011
242011
Constrained de novo peptide identification via multi-objective optimization
JM Malard, A Heredia-Langner, DJ Baxter, KH Jarman, WR Cannon
18th International Parallel and Distributed Processing Symposium, 2004 …, 2004
212004
Prediction of metabolite concentrations, rate constants and post-translational regulation using maximum entropy-based simulations with application to central metabolism of …
WR Cannon, JD Zucker, DJ Baxter, N Kumar, SE Baker, JM Hurley, ...
Processes 6 (6), 63, 2018
172018
Evaluation of the influence of amino acid composition on the propensity for collision-induced dissociation of model peptides using molecular dynamics simulations
WR Cannon, D Taasevigen, DJ Baxter, J Laskin
Journal of the American Society for Mass Spectrometry 18 (9), 1625-1637, 2007
162007
A scalable parallel approach for peptide identification from large-scale mass spectrometry data
G Kulkarni, A Kalyanaraman, WR Cannon, D Baxter
2009 International Conference on Parallel Processing Workshops, 423-430, 2009
122009
ISiCLE: a molecular collision cross section calculation pipeline for establishing large in silico reference libraries for compound identification
SM Colby, DG Thomas, JR Nunez, DJ Baxter, KR Glaesemann, JM Brown, ...
arXiv preprint arXiv:1809.08378, 2018
72018
Peptide identification via constrained multi‐objective optimization: Pareto‐based genetic algorithms
JM Malard, A Heredia‐Langner, WR Cannon, R Mooney, DJ Baxter
Concurrency and Computation: Practice and Experience 17 (14), 1687-1704, 2005
72005
Comparison of optimal thermodynamic models of the tricarboxylic acid cycle from heterotrophs, cyanobacteria, and green sulfur bacteria
DG Thomas, S Jaramillo-Riveri, DJ Baxter, WR Cannon
The Journal of Physical Chemistry B 118 (51), 14745-14760, 2014
62014
Proteotyping of microbial communities by optimization of tandem mass spectrometry data interpretation
A Hugo, DJ Baxter, WR Cannon, A Kalyanaraman, G Kulkarni, ...
Biocomputing 2012, 225-234, 2012
42012
Applications in data-intensive computing
AR Shah, JN Adkins, DJ Baxter, WR Cannon, DG Chavarria-Miranda, ...
Advances in Computers 79, 1-70, 2010
32010
Enumeration reduction algorithm for the characterization of multi-primary LED systems
D Baxter, D Durmus, M Royer
Lighting Research & Technology 55 (3), 242-257, 2023
22023
Enabling High-throughput Atmospheric Simulations for Radionuclide Background and Source Estimation
W Rosenthal, P Eslinger, B Schrom, D Baxter, H Miley
AGU Fall Meeting Abstracts 2020, S050-02, 2020
2020
Prediction of Metabolite Concentrations, Rate Constants and Post-Translational Regulation of Neurospora Crassa using Maximum Entropy Optimizations and Reinforcement Learning
WR Cannon, SR Britton, M Banwarth-Kuhn, M Alber, JM Hurley, ...
Biophysical Journal 116 (3), 130a-131a, 2019
2019
Modeling the Mass Action Dynamics of Metabolism with Fluctuation Theorems and Maximum Entropy
W Cannon, D Thomas, D Baxter, J Zucker, G Goh
APS March Meeting Abstracts 2016, F41. 006, 2016
2016
Simulating Metabolism with Statistical Thermodynamics
WR Cannon, DG Thomas, DJ Baxter
Biophysical Journal 108 (2), 470a, 2015
2015
Analyzing Data for Systems Biology: Working at the Intersection of Thermodynamics and Data Analytics
WR Cannon, DJ Baxter
Pacific Northwest National Lab.(PNNL), Richland, WA (United States …, 2012
2012
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