Zobrazeno 1 - 3
of 3
pro vyhledávání: '"Juan J Pérez González"'
Autor:
José M Granadino-Roldán, Antonia S J S Mey, Juan J Pérez González, Stefano Bosisio, Jaime Rubio-Martinez, Julien Michel
Publikováno v:
PLoS ONE, Vol 14, Iss 3, p e0213217 (2019)
Hit-to-lead virtual screening frequently relies on a cascade of computational methods that starts with rapid calculations applied to a large number of compounds and ends with more expensive computations restricted to a subset of compounds that passed
Externí odkaz:
https://doaj.org/article/217fcda8e93e43629c6a1c6fac7e330c
We present here a computational multistep procedure that tries to find compounds from the Selleck FDA approved drugs and the Selleck database of Natural Products able to interact with the S-protein of SARS-CoV-2 and inhibit its interactions with huma
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::1574c5147e388b9f4c1e7e8056fbdf81
https://doi.org/10.26434/chemrxiv-2022-n2zmh
https://doi.org/10.26434/chemrxiv-2022-n2zmh
Autor:
José M, Granadino-Roldán, Antonia S J S, Mey, Juan J, Pérez González, Stefano, Bosisio, Jaime, Rubio-Martinez, Julien, Michel
Publikováno v:
PLoS ONE
Hit-to-lead virtual screening frequently relies on a cascade of computational methods that starts with rapid calculations applied to a large number of compounds and ends with more expensive computations restricted to a subset of compounds that passed
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=pmid________::94274eeb96583c08cddf718c9b15a6f4
https://pubmed.ncbi.nlm.nih.gov/30861030
https://pubmed.ncbi.nlm.nih.gov/30861030