CoMPARA: Collaborative Modeling Project for Androgen Receptor Activity

Author:

Mansouri Kamel123,Kleinstreuer Nicole4,Abdelaziz Ahmed M.5,Alberga Domenico6,Alves Vinicius M.78,Andersson Patrik L.9,Andrade Carolina H.7,Bai Fang10,Balabin Ilya11,Ballabio Davide12,Benfenati Emilio13,Bhhatarai Barun14,Boyer Scott15,Chen Jingwen16,Consonni Viviana12,Farag Sherif8,Fourches Denis17,García-Sosa Alfonso T.18,Gramatica Paola14,Grisoni Francesca12,Grulke Chris M.1,Hong Huixiao19,Horvath Dragos20,Hu Xin21,Huang Ruili21,Jeliazkova Nina22,Li Jiazhong10,Li Xuehua16,Liu Huanxiang10,Manganelli Serena13,Mangiatordi Giuseppe F.6,Maran Uko18,Marcou Gilles20,Martin Todd23,Muratov Eugene8,Nguyen Dac-Trung21,Nicolotti Orazio6,Nikolov Nikolai G.24,Norinder Ulf15,Papa Ester14,Petitjean Michel25,Piir Geven18,Pogodin Pavel26,Poroikov Vladimir26,Qiao Xianliang16,Richard Ann M.1,Roncaglioni Alessandra13,Ruiz Patricia27,Rupakheti Chetan2328,Sakkiah Sugunadevi19,Sangion Alessandro14,Schramm Karl-Werner5,Selvaraj Chandrabose19,Shah Imran1,Sild Sulev18,Sun Lixia29,Taboureau Olivier25,Tang Yun29,Tetko Igor V.3031,Todeschini Roberto12,Tong Weida19,Trisciuzzi Daniela6,Tropsha Alexander8,Van Den Driessche George17,Varnek Alexandre20,Wang Zhongyu16,Wedebye Eva B.24,Williams Antony J.1,Xie Hongbin16,Zakharov Alexey V.21,Zheng Ziye9,Judson Richard S.1

Affiliation:

1. National Center for Computational Toxicology, Office of Research and Development, U.S. Environmental Protection Agency (U.S. EPA), Research Triangle Park, North Carolina, USA

2. ScitoVation LLC, Research Triangle Park, North Carolina, USA

3. Integrated Laboratory Systems, Inc., Morrisville, North Carolina, USA

4. National Toxicology Program Interagency Center for the Evaluation of Alternative Toxicological Methods (NICEATM), National Institute of Environmental Health Sciences, Research Triangle Park, North Carolina, USA

5. Technische Universität München, Wissenschaftszentrum Weihenstephan für Ernährung, Landnutzung und Umwelt, Department für Biowissenschaftliche Grundlagen, Weihenstephaner Steig 23, 85350 Freising, Germany

6. Department of Pharmacy-Drug Sciences, University of Bari, Bari, Italy

7. Laboratory for Molecular Modeling and Drug Design, Faculty of Pharmacy, Federal University of Goiás, Goiânia, Brazil

8. Laboratory for Molecular Modeling, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina, USA

9. Chemistry Department, Umeå University, Umeå, Sweden

10. School of Pharmacy, Lanzhou University, China

11. Information Systems & Global Solutions (IS&GS), Lockheed Martin, USA

12. Milano Chemometrics and QSAR Research Group, Department of Earth and Environmental Sciences, University of Milano-Bicocca, Milan, Italy

13. Istituto di Ricerche Farmacologiche “Mario Negri”, IRCCS, Milan, Italy

14. QSAR Research Unit in Environmental Chemistry and Ecotoxicology, Department of Theoretical and Applied Sciences, University of Insubria, Varese, Italy

15. Swedish Toxicology Sciences Research Center, Karolinska Institutet, Södertälje, Sweden

16. School of Environmental Science and Technology, Dalian University of Technology, Dalian, China

17. Department of Chemistry, Bioinformatics Research Center, North Carolina State University, Raleigh, North Carolina, USA

18. Institute of Chemistry, University of Tartu, Tartu, Estonia

19. Division of Bioinformatics and Biostatistics, National Center for Toxicology Research, U.S. Food and Drug Administration, Jefferson, Arkansas, USA

20. Laboratoire de Chémoinformatique—UMR7140, University of Strasbourg/CNRS, Strasbourg, France

21. National Center for Advancing Translational Sciences, National Institutes of Health, Rockville, Maryland, USA

22. IdeaConsult, Ltd., Sofia, Bulgaria

23. National Risk Management Research Laboratory, U.S. EPA, Cincinnati, Ohio, USA

24. Division of Risk Assessment and Nutrition, National Food Institute, Technical University of Denmark, Copenhagen, Denmark

25. Computational Modeling of Protein-Ligand Interactions (CMPLI)–INSERM UMR 8251, INSERM ERL U1133, Functional and Adaptative Biology (BFA), Universite de Paris, Paris, France

26. Institute of Biomedical Chemistry IBMC, 10 Building 8, Pogodinskaya st., Moscow 119121, Russia

27. Computational Toxicology and Methods Development Laboratory, Division of Toxicology and Human Health Sciences, Agency for Toxic Substances and Disease Registry, Centers for Disease Control and Prevention, Atlanta, Georgia, USA

28. Department of Biochemistry and Molecular Biophysics, University of Chicago, Chicago, Illinois, USA

29. Department of Pharmaceutical Sciences, School of Pharmacy, East China University of Science and Technology, Shanghai, China

30. BIGCHEM GmbH, Neuherberg, Germany

31. Helmholtz Zentrum Muenchen – German Research Center for Environmental Health (GmbH), Neuherberg, Germany

Publisher

Environmental Health Perspectives

Subject

Health, Toxicology and Mutagenesis,Public Health, Environmental and Occupational Health

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