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Results 11 - 20 of about 114
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Pastor M, Gómez-Tamayo JC, Sanz F. Flame: an open source framework for model development, hosting, and usage in production environments. J Cheminform, 2021; 13(1): 31 DOI: https://doi.org/10.1186/s13321-021-00509-z.
2021
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Pognan F, Steger-Hartmann T, Díaz C, Blomberg N, Bringezu F, Briggs K, Callegaro G, Capella-Gutierrez S, Centeno E, Corvi J, Drew P, Drewe WC, Fernández JM, Furlong LI, Guney E, Kors JA, Mayer MA, Pastor M, Piñero J, Ramírez-Anguita JM, Ronzano F, Rowell P, Saüch-Pitarch J, Valencia A, van de Water B, van der Lei J, van Mulligen E, Sanz F. The eTRANSAFE Project on Translational Safety Assessment through Integrative Knowledge Management: Achievements and Perspectives. Pharmaceuticals (Basel), 2021; 14(3):237 DOI: 10.3390/ph14030237.
2021
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Briggs K, Bosc N, Camara T, Diaz C, Drew P, Drewe WC, Kors J, Van Mulligen E, Pastor M, Pognan F, Quintana JR, Sarntivijai S, Steger-Hartmann T. Guidelines for FAIR sharing of preclinical safety and off-target pharmacology data. ALTEX, 2021 . PMID: 33637997 . DOI: 10.14573/altex.2011181.
2021
Original articles in indexed journals - PharmacoInformatics
Cotrina EY, Blasi D, Vilà M, Planas A, Abad-Zapatero C, Centeno NB, Quintana J, Arsequell G. Optimization of kinetic stabilizers of tetrameric transthyretin: A prospective ligand efficiency-guided approach. Bioorg Med Chem, 2020; 28(23):115794. doi: 10.1016/j.bmc.2020.115794. PMID:. PMID: 33091848 . DOI: 10.1016/j.bmc.2020.115794.
2020
Original articles in indexed journals - PharmacoInformatics
Krebs A, van Vugt-Lussenburg BMA, Waldmann T et al (including Pastor M). The EU-ToxRisk method documentation, data processing and chemical testing pipeline for the regulatory use of new approach methods. Arch Toxicol, 2020. PMID: 32632539 . DOI: https://doi.org/10.1007/s00204-020-02802-6.
2020
Original articles in indexed journals - PharmacoInformatics
Rovida C, Barton-Maclaren T, Benfenati E, Caloni F, Chandrasekera C, Chesne C, Cronin M, De Knecht J, Dietrich D, Escher S, Fitzpatrick S, Flannery B, Herzler M, Hougaard Bennekou S, Hubesch B, Kamp H, Kisitu J, Kleinstreuer N, Kovarich S, Leist M, Maertens A, Nugent K, Pallocca G, Pastor M, Patlewicz G, Pavan M, Presgrave O, Smirnova L, Schwarz M, Yamada T, Hartung T. Internationalization of read-across as a validated new approach method (NAM) for regulatory toxicology. ALTEX, 2020.. PMID: 32369604 . DOI: 10.14573/altex.1912181.
2020
Original articles in indexed journals - PharmacoInformatics
Krebs A, Nyffeler J, Karreman C, Schmidt BZ, Kappenberg F, Mellert J, Pallocca G, Pastor M, Rahnenführer J, Leist M. Determination of benchmark concentrations and their statistical uncertainty for cytotoxicity test data and functional in vitro assays. ALTEX, 2020; 37 (1): 155-163. PMID: 31833558 . DOI: 10.14573/altex.1912021.
2020
Original articles in indexed journals - PharmacoInformatics
Escher SE*, Kamp H, Bennekou SH, Bitsch A, Fisher C, Graepel R, Hengstler JG, Herzler M, Knight D, Leist M, Norinder U, Ouédraogo G, Pastor M, Stuard S, White A, Zdrazil B, van de Water B, Kroese D. Towards grouping concepts based on new approach methodologies in chemical hazard assessment: the read-across approach of the EU-ToxRisk project. Arch Toxicol, 2019; 93(12): 3643-3667.. PMID: 31781791 . DOI: 10.1007/s00204-019-02591-7.
2019
Original articles in indexed journals - Integrative Biomedical Informatics - PharmacoInformatics
Llopis J, Cano J, Gomis-Tena J, Romero L, Sanz F, Pastor M, Trenor B, Saiz J. In silico assay for preclinical assessment of drug proarrhythmicity. J Pharmacol Toxicol Methods, 2019 ;99: 106595. PMID: 31962986 . DOI: 10.1016/j.vascn.2019.05.106.
2019
Original articles in indexed journals - PharmacoInformatics
Radchenko T, Fontaine F, Morettoni L, Zamora I. Software-aided workflow for predicting protease-specific cleavage sites using physicochemical properties of the natural and unnatural amino acids in peptide-based drug discovery. PLoS One, 2019; 14(1): e0199270. PMID: 30620739 . DOI: 10.1371/journal.pone. 0199270.
2019
