Francisco Torrens

TL;DR: A novel atom-level chemical descriptor has been applied to estimate the anthelmintic activity and results suggest that the proposed method will be a good tool for studying the biological properties of drug candidates during the early state of the drug-development process.

TL;DR: 3D-chiral TOMOCOMD-CARDD approach provides a powerful alternative to 3D-QSAR and prediction of the biological activities of chiral 3-(3-hydroxyphenyl)piperidines, which are sigma-receptor antagonists, by linear multiple regression analysis was carried out.

TL;DR: A virtual screening of 87 new compounds reported in the antiinfective field with antibacterial activities is developed showing the ability of the TOMOCOMD-CARDD models to identify new leads as antibacterial.

TL;DR: The fitted discriminant functions were used in the selection/identification of new ethylsteroids isolated from herbal plants, looking for tyrosinase inhibitory activity, and provided useful clues that can be used to speed up in the identification of new tyosinase inhibitor compounds.

TL;DR: A detailed composition analysis was performed for 22 diverse oils and fats and included determination of tocopherols (α, γ and δ), β-carotene, chlorophyll, total phenolic compounds (TPC) and fatty acid (FA) composition, as well as the determination of their oxidative stability (Rancimat test) as mentioned in this paper.