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Modeling the Evolution of Crosslinked and Extractable Material in an Oil‐Based Paint Model System.
- Published in:
- Angewandte Chemie, 2018, v. 130, n. 25, p. 7535, doi. 10.1002/ange.201801332
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- Article
Catalyst Screening through Quantum Chemical Calculations and Microkinetic Modeling: Hydrolysis of Carbon Dioxide.
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- Theoretical Foundations of Chemical Engineering, 2017, v. 51, n. 6, p. 949, doi. 10.1134/S0040579517060124
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- Article
Modeling the Evolution of Crosslinked and Extractable Material in an Oil‐Based Paint Model System.
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- Angewandte Chemie International Edition, 2018, v. 57, n. 25, p. 7413, doi. 10.1002/anie.201801332
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- Article
In silico feasibility of novel biodegradation pathways for 1,2,4-trichlorobenzene.
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- BMC Systems Biology, 2010, v. 4, p. 1
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- Article
Exploring De Novo metabolic pathways from pyruvate to propionic acid.
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- Biotechnology Progress, 2016, v. 32, n. 2, p. 303, doi. 10.1002/btpr.2233
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- Article
Kinetic Monte Carlo Tool for Kinetic Modeling of Linear Step‐Growth Polymerization: Insight into Recycling of Polyurethanes.
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- Macromolecular Theory & Simulations, 2022, v. 31, n. 2, p. 1, doi. 10.1002/mats.202100058
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- Article
A Combined Computational and Experimental Study of Copolymerization Propagation Kinetics for 1-Ethylcyclopentyl methacrylate and Methyl methacrylate.
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- Macromolecular Theory & Simulations, 2016, v. 25, n. 3, p. 263, doi. 10.1002/mats.201500072
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Design of Copolymers Based on Sequence Distribution for a Targeted Molecular Weight and Conversion.
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- Macromolecular Theory & Simulations, 2014, v. 23, n. 9, p. 564, doi. 10.1002/mats.201400037
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- Article
Kinetic Study of 1,5-Hydrogen Transfer Reactions of Methyl Acrylate and Butyl Acrylate Using Quantum Chemistry.
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- Macromolecular Theory & Simulations, 2012, v. 21, n. 7, p. 461, doi. 10.1002/mats.201200005
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Macromol. Theory Simul. 3/2011.
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- Macromolecular Theory & Simulations, 2011, v. 20, n. 3, p. n/a, doi. 10.1002/mats.201190005
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Model-Based Design for Preparing Styrene/Methyl Methacrylate Structural Gradient Copolymers.
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- Macromolecular Theory & Simulations, 2011, v. 20, n. 3, p. 191, doi. 10.1002/mats.201000076
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- Article
Tracking Explicit Chain Sequence in Kinetic Monte Carlo Simulations.
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- Macromolecular Theory & Simulations, 2011, v. 20, n. 1, p. 54, doi. 10.1002/mats.201000041
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- Article
Computational screening of novel thiamine-catalyzed decarboxylation reactions of 2-keto acids.
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- Bioprocess & Biosystems Engineering, 2011, v. 34, n. 3, p. 375, doi. 10.1007/s00449-010-0481-z
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- Article
The Role of Oxazolidinones in l-Proline-Assisted Aldol-Type Reactions.
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- Topics in Catalysis, 2010, v. 53, n. 15-18, p. 1031, doi. 10.1007/s11244-010-9527-3
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- Article
Fast pyrolysis of glucose-based carbohydrates with added NaCl part 2: Validation and evaluation of the mechanistic model.
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- AIChE Journal, 2016, v. 62, n. 3, p. 778, doi. 10.1002/aic.15107
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- Article
Fast pyrolysis of glucose-based carbohydrates with added NaCl part 1: Experiments and development of a mechanistic model.
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- AIChE Journal, 2016, v. 62, n. 3, p. 766, doi. 10.1002/aic.15106
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- Article
Computational screening of metal-organic frameworks for xenon/krypton separation.
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- AIChE Journal, 2011, v. 57, n. 7, p. 1759, doi. 10.1002/aic.12397
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- Article
A Multiscale Scheme for Modeling Catalytic Flow Reactors.
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- AIChE Journal, 2006, v. 52, n. 12, p. 4214, doi. 10.1002/aic.11030
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- Article
Multiscale Modeling of Transport and Residence Times in Nanostructured Membranes.
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- AIChE Journal, 2006, v. 52, n. 11, p. 3679, doi. 10.1002/aic.10998
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- Article
Lexicography of Kinetic Modeling of Complex Reaction Networks.
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- AIChE Journal, 2005, v. 51, n. 8, p. 2112, doi. 10.1002/aic.10599
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- Article
Microkinetic models and dynamic Monte Carlo simulations of nonuniform catalytic systems.
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- AIChE Journal, 2001, v. 47, n. 5, p. 1193, doi. 10.1002/aic.690470525
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- Article
Mechanism reduction during computer generation of compact reaction models.
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- AIChE Journal, 1997, v. 43, n. 7, p. 1828, doi. 10.1002/aic.690430718
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- Article
Kinetics of Substituted Silylene Addition and Elimination in Silicon Nanocluster Growth Captured by Group Additivity.
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- ChemPhysChem, 2010, v. 11, n. 9, p. 1978, doi. 10.1002/cphc.200900836
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- Article
Contra-thermodynamic Behavior in Intermolecular Hydrogen Transfer of Alkylperoxy Radicals.
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- ChemPhysChem, 2007, v. 8, n. 13, p. 1969, doi. 10.1002/cphc.200700161
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Analysis of the maximum theoretical yield for the synthesis of erythromycin precursors in Escherichia coli.
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- Biotechnology & Bioengineering, 2006, v. 95, n. 4, p. 638, doi. 10.1002/bit.20925
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- Article
The 1-D hindered rotor approximation.
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- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2007, v. 118, n. 5/6, p. 881, doi. 10.1007/s00214-007-0376-5
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- Article
MINE 2.0: enhanced biochemical coverage for peak identification in untargeted metabolomics.
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- Bioinformatics, 2022, v. 38, n. 13, p. 3484, doi. 10.1093/bioinformatics/btac331
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- Article
Dynamic, Large-Scale Profiling of Transcription Factor Activity from Live Cells in 3D Culture.
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- PLoS ONE, 2010, v. 5, n. 11, p. 1, doi. 10.1371/journal.pone.0014026
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Influence of poly(arylether sulfone) molecular weight distribution on measures of global thermal stability.
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- Journal of Applied Polymer Science, 1995, v. 58, n. 8, p. 1325, doi. 10.1002/app.1995.070580814
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- Article
Thermal degradation of aliphatic-aromatic polyamides: Kinetics of N, N′-Dihexylisophthalamide neat and in presence of copper lodide.
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- Journal of Applied Polymer Science, 1995, v. 56, n. 7, p. 803, doi. 10.1002/app.1995.070560705
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- Article
Characterizing and predicting carboxylic acid reductase activity for diversifying bioaldehyde production.
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- Biotechnology & Bioengineering, 2016, v. 113, n. 5, p. 944, doi. 10.1002/bit.25860
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Dynamic transcription factor activity profiling in 2D and 3D cell cultures.
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- Biotechnology & Bioengineering, 2013, v. 110, n. 2, p. 563, doi. 10.1002/bit.24718
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Cellular arrays for large-scale analysis of transcription factor activity.
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- Biotechnology & Bioengineering, 2011, v. 108, n. 2, p. 395, doi. 10.1002/bit.22916
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Discovery and analysis of novel metabolic pathways for the biosynthesis of industrial chemicals: 3-hydroxypropanoate.
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- Biotechnology & Bioengineering, 2010, v. 106, n. 3, p. 462, doi. 10.1002/bit.22673
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- Article
Computational framework for predictive biodegradation.
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- Biotechnology & Bioengineering, 2009, v. 104, n. 6, p. 1086, doi. 10.1002/bit.22489
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Thermodynamic analysis of biodegradation pathways.
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- Biotechnology & Bioengineering, 2009, v. 103, n. 3, p. 532, doi. 10.1002/bit.22285
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MINEs: open access databases of computationally predicted enzyme promiscuity products for untargeted metabolomics.
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- Journal of Cheminformatics, 2015, v. 7, n. 1, p. 1, doi. 10.1186/s13321-015-0087-1
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Low Conversion 4-Acetoxystyrene Free-Radical Polymerization Kinetics Determined by Pulsed-Laser and Thermal Polymerization.
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- Macromolecular Chemistry & Physics, 2006, v. 207, n. 16, p. 1429, doi. 10.1002/macp.200600232
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Insights into the Relationship of Catalytic Activity and Structure: A Comparison Study of Three Carbonic Anhydrase Mimics.
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- International Journal of Chemical Kinetics, 2014, v. 46, n. 11, p. 683, doi. 10.1002/kin.20879
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- Article
Ligands, Receptors, and Transcription Factors that Mediate Inter-Cellular and Intra-Cellular Communication during Ovarian Follicle Development.
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- Reproductive Sciences, 2020, v. 27, n. 2, p. 690, doi. 10.1007/s43032-019-00075-8
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Dynamic genome-scale cell-specific metabolic models reveal novel inter-cellular and intra-cellular metabolic communications during ovarian follicle development.
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- BMC Bioinformatics, 2019, v. 20, n. 8, p. 1, doi. 10.1186/s12859-019-2825-2
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A genome-scale metabolic reconstruction for Escherichia coli K-12 MG1655 that accounts for 1260 ORFs and thermodynamic information.
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- Molecular Systems Biology, 2007, v. 3, n. 1, p. 121, doi. 10.1038/msb4100155
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Estimation of Free Radical Polymerization Rate Coefficients Using Computational Chemistry.
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- Macromolecular Symposia, 2006, v. 243, n. 1, p. 179, doi. 10.1002/masy.200651117
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- Article
Redesigned Nylon 6 Variants with Enhanced Recyclability, Ductility, and Transparency.
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- Angewandte Chemie, 2024, v. 136, n. 17, p. 1, doi. 10.1002/ange.202320214
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- Article
Microarray analysis identifies COMP as the most differentially regulated transcript throughout in vitro follicle growth.
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- Molecular Reproduction & Development, 2013, v. 80, n. 2, p. 132, doi. 10.1002/mrd.22144
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A Critical Review on Hemicellulose Pyrolysis.
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- Energy Technology, 2017, v. 5, n. 1, p. 52, doi. 10.1002/ente.201600327
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Inside Back Cover: A Critical Review on Hemicellulose Pyrolysis (Energy Technol. 1/2017).
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- Energy Technology, 2017, v. 5, n. 1, p. 217, doi. 10.1002/ente.201600396
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- Article
Corrigendum: A Critical Review on Hemicellulose Pyrolysis.
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- Energy Technology, 2017, v. 5, n. 1, p. 216, doi. 10.1002/ente.201600667
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- Article
Redesigned Nylon 6 Variants with Enhanced Recyclability, Ductility, and Transparency.
- Published in:
- Angewandte Chemie International Edition, 2024, v. 63, n. 17, p. 1, doi. 10.1002/anie.202320214
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- Article
Graduate Student Teaching Fellowship Program.
- Published in:
- CEE: Chemical Engineering Education, 2014, v. 48, n. 1, p. 37
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- Article