Predictive Structure-Based Toxicology Approaches To Assess the Androgenic Potential of Chemicals
Chemical structures, RMSD values, docking scores, additional tables and figures, and methodological details (PDF)
Additional information concerning the starting data set, EPA-ARDB.csv (CSV)
Additional information concerning V1, V1_SI.csv (CSV)
Additional information concerning V2, V2_SI.csv (CSV)
Additional information concerning V3, V3_SI.csv (CSV).
This dataset is associated with the following publication:
Trisciuzzi, D., D. Alberga, K. Mansouri, R. Judson, E. Novellino, G.F. Mangiatordi, and O. Nicolotti. Predictive structure-based toxicology approaches to assess the androgenic potential of chemicals. Journal of Chemical Information and Modeling. American Chemical Society, Washington, DC, USA, 57(11): 2874-2884, (2017).
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Complete Metadata
| @type | dcat:Dataset |
|---|---|
| accessLevel | public |
| bureauCode |
[ "020:00" ] |
| contactPoint |
{ "fn": "Alexander Hanf", "hasEmail": "mailto:hanf.alexander@epa.gov" } |
| description | Chemical structures, RMSD values, docking scores, additional tables and figures, and methodological details (PDF) Additional information concerning the starting data set, EPA-ARDB.csv (CSV) Additional information concerning V1, V1_SI.csv (CSV) Additional information concerning V2, V2_SI.csv (CSV) Additional information concerning V3, V3_SI.csv (CSV). This dataset is associated with the following publication: Trisciuzzi, D., D. Alberga, K. Mansouri, R. Judson, E. Novellino, G.F. Mangiatordi, and O. Nicolotti. Predictive structure-based toxicology approaches to assess the androgenic potential of chemicals. Journal of Chemical Information and Modeling. American Chemical Society, Washington, DC, USA, 57(11): 2874-2884, (2017). |
| distribution |
[ { "title": "https://doi.org/10.1021/acs.jcim.7b00420", "accessURL": "https://doi.org/10.1021/acs.jcim.7b00420" } ] |
| identifier | https://doi.org/10.23719/1504460 |
| keyword |
[ "Androgen receptor", "CoMPARA", "ExpoCast", "exposure", "in silico" ] |
| license | https://pasteur.epa.gov/license/sciencehub-license.html |
| modified | 2017-10-12 |
| programCode |
[ "020:095" ] |
| publisher |
{ "name": "U.S. EPA Office of Research and Development (ORD)", "subOrganizationOf": { "name": "U.S. Environmental Protection Agency", "subOrganizationOf": { "name": "U.S. Government" } } } |
| references |
[ "https://doi.org/10.1021/acs.jcim.7b00420" ] |
| rights |
null
|
| title | Predictive Structure-Based Toxicology Approaches To Assess the Androgenic Potential of Chemicals |
