Antony John Williams, 0000-0002-2668-4821

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Christopher M GrulkeCenter of Computational Toxicology and Exposure, Environmental Protection AgencyEmail verificata su epa.gov
Valery TkachenkoPresident, Science Data ExpertsEmail verificata su sciencedataexperts.com
sean ekinsCollaborations Pharmaceuticals, Inc.Email verificata su collaborationspharma.com
Kirill BlinovSenior Software Developer, Molecule AppsEmail verificata su moleculeapps.com
Mikhail ElyashbergProfessor, Dr. Sci., Senior Scientist, Advanced Chemistry Development (ACD)Email verificata su acdlabs.ru
Kamel Mansouri [orcid:0000-0002-642...Computational Chemist at NIH/NIEHS/DNTP/NICEATMEmail verificata su nih.gov
Gary E. MartinCo-Editor-in-Chief, Magnetic Resonance in Chemistry; Adjunct Professor of Chemistry, Seton HallEmail verificata su shu.edu
Andrew McEachran, 0000-0003-1423-...Application Scientist at Agilent TechnologiesEmail verificata su agilent.com
Richard JudsonUS EPA, National Center for Computational ToxicologyEmail verificata su epa.gov
John WambaughResearch Physical Scientist, U.S. Environmental Protection AgencyEmail verificata su epa.gov
Grace PatlewiczUS EPAEmail verificata su epa.gov
Nancy BakerLeidos/EPA/ParlezChemEmail verificata su epa.gov
Seth R. NewtonChemist, Environmental Protection AgencyEmail verificata su epa.gov
Alex M. ClarkPresident, Molecular Materials InformaticsEmail verificata su molmatinf.com
Imran ShahComputational Systems Biologist, US EPAEmail verificata su epa.gov
Mark StrynarUS EPAEmail verificata su epa.gov
Russell S ThomasDirector, Center for Computational Toxicology and Exposure, U.S. Environmental Protection AgencyEmail verificata su epa.gov
Egon WillighagenAssistant Professor at BiGCaT, NUTRIM, Maastricht University The Netherlands, ORCID:0000-0001-7542Email verificata su maastrichtuniversity.nl
Carole GobleProfessor of Computer Science, University of ManchesterEmail verificata su cs.man.ac.uk
Chris EveloHead Department of Bioinformatics - BiGCaT, Maastricht University ORCID:0000-0002-5301-3142Email verificata su maastrichtuniversity.nl

Antony John Williams, 0000-0002-2668-4821

Center of Computational Toxicology and Exposure, Environmental Protection Agency

Email verificata su epa.gov - Home page

Chemistry Cheminformatics Nuclear Magnetic Resonance Drug Discovery


Titolo Ordina per citazioni Ordina per anno Ordina per titolo	Citata da Citata da	Anno
ChemSpider: an online chemical information resource HE Pence, A Williams Journal of Chemical Education 87 (11), 1123-1124, 2010	736	2010
Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information I Sushko, S Novotarskyi, R Körner, AK Pandey, M Rupp, W Teetz, ... Journal of computer-aided molecular design 25 (6), 533-554, 2011	321	2011
Open PHACTS: semantic interoperability for drug discovery AJ Williams, L Harland, P Groth, S Pettifer, C Chichester, EL Willighagen, ... Drug discovery today 17 (21-22), 1188-1198, 2012	315	2012
ToxCast chemical landscape: paving the road to 21st century toxicology AM Richard, RS Judson, KA Houck, CM Grulke, P Volarath, ... Chemical research in toxicology 29 (8), 1225-1251, 2016	294	2016
In silico repositioning of approved drugs for rare and neglected diseases S Ekins, AJ Williams, MD Krasowski, JS Freundlich Drug discovery today 16 (7), 298-310, 2011	256	2011
The CompTox Chemistry Dashboard: a community data resource for environmental chemistry AJ Williams, CM Grulke, J Edwards, AD McEachran, K Mansouri, ... Journal of cheminformatics 9 (1), 1-27, 2017	240	2017
Smart phones, a powerful tool in the chemistry classroom AJ Williams, HE Pence Journal of Chemical Education 88 (6), 683-686, 2011	200	2011
Major structural components in freshwater dissolved organic matter B Lam, A Baer, M Alaee, B Lefebvre, A Moser, A Williams, AJ Simpson Environmental Science & Technology 41 (24), 8240-8247, 2007	199	2007
Identification of “Known Unknowns” Utilizing Accurate Mass Data and ChemSpider APVT James L. Little, Antony J. Williams Journal of the American Society of Mass Spectrometry 23 (1), 179-85, 2012	144*	2012
Computer-assisted structure verification and elucidation tools in NMR-based structure elucidation ME Elyashberg, AJ Williams, GE Martin Progress in Nuclear Magnetic Resonance Spectroscopy 53 (1-2), 1-104, 2008	131	2008
Linking high resolution mass spectrometry data with exposure and toxicity forecasts to advance high-throughput environmental monitoring JE Rager, MJ Strynar, S Liang, RL McMahen, AM Richard, CM Grulke, ... Environment international 88, 269-280, 2016	116	2016
The ChEMBL database as linked open data EL Willighagen, A Waagmeester, O Spjuth, P Ansell, AJ Williams, ... Journal of cheminformatics 5 (1), 1-12, 2013	103	2013
Towards a gold standard: regarding quality in public domain chemistry databases and approaches to improving the situation. AJ Williams, S Ekins, V Tkachenko Drug Discovery Today 17 (13-14), 685-701, 2012	100	2012
Improved baseline recognition and modeling of FT NMR spectra S Golotvin, A Williams Journal of Magnetic Resonance 146 (1), 122-125, 2000	100	2000
A quality alert and call for improved curation of public chemistry databases AJ Williams, S Ekins Drug Discovery Today 16 (17-18), 747-750, 2011	95	2011
A predictive ligand-based Bayesian model for human drug-induced liver injury S Ekins, AJ Williams, JJ Xu Drug Metabolism and Disposition 38 (12), 2302-2308, 2010	95	2010
OPERA models for predicting physicochemical properties and environmental fate endpoints K Mansouri, CM Grulke, RS Judson, AJ Williams Journal of cheminformatics 10 (1), 1-19, 2018	94	2018
Internet-based tools for communication and collaboration in chemistry AJ Williams Drug discovery today 13 (11-12), 502-506, 2008	93	2008
A bibliometric review of drug repurposing NC Baker, S Ekins, AJ Williams, A Tropsha Drug discovery today 23 (3), 661-672, 2018	92	2018
A combined atomic force microscopy and computational approach for the structural elucidation of breitfussin A and B: Highly modified halogenated dipeptides from Thuiaria breitfussi KØ Hanssen, B Schuler, AJ Williams, TB Demissie, E Hansen, ... Angewandte Chemie 124 (49), 12404-12407, 2012	92	2012

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