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James R. Rabinowitz

Research Triangle Park
United States Environmental Protection Agency

39

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829

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Rapid experimental measurements of physicochemical properties to inform models and testing

2018 Science of The Total Environment
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High-throughput in-silico prediction of ionization equilibria for pharmacokinetic modeling

2018 Science of The Total Environment
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High-throughput models for exposure-based chemical prioritization in the ExpoCast project.

2013 Environmental Science & Technology
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In Silico Strategies for Modeling Stereoselective Metabolism of Pyrethroids

2012
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Activity profiles of 309 ToxCast™ chemicals evaluated across 292 biochemical targets☆

2011 Toxicology
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Multipole expansion techniques for the calculation and characterization of molecular electrostatic potentials

2009 International Journal of Quantum Chemistry
- James R. Rabinowitz
- Stephen B. Little
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Molecular Modeling for Screening Environmental Chemicals for Estrogenicity: Use of the Toxicant-Target Approach

2009 Chemical Research in Toxicology
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Comparative in silico modeling of environmental and therapeutic classes of perfluorinated chemicals (PFCS): ADME properties, virtual receptor profiling and generalized PBPK models

2009 Reproductive Toxicology
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Computational Toxicology—A State of the Science Mini Review

2008 Toxicological Sciences
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Why does 5‐methylchrysene interact with DNA as both a planar and a nonplanar polycyclic aromatic hydrocarbon? Quantum mechanical studies

2002 International Journal of Quantum Chemistry
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