Evaluation of log Po/w values of drugs from some molecular structure calculation software

Autor: Martí Rosés, Clara Ràfols, Rosalia Pascual, Adriana Port, Juan M. Pallicer, Elisabeth Bosch

Publikováno v: ADMET and DMPK
Volume 2
Issue 2
Recercat. Dipósit de la Recerca de Catalunya
instname
ADMET and DMPK, Vol 2, Iss 2, Pp 107-114 (2014)
Dipòsit Digital de la UB
Universidad de Barcelona

Predictive software packages to estimate the lipophilicity of molecules have become key tools in the new drug design. Six different well-known computational programs including the classical BioByte-clogP and the GALAS algorithm offered by ACDlabs wer

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a19e10be94222986ece4376aa0f08652
https://hrcak.srce.hr/125176