Gozalbes, Rafael; Vicente de Julián-Ortiz, Jesús - In: International Journal of Quantitative … 3 (2018) 1, pp. 1-24
Chemoinformatics methodologies such as QSAR/QSPR have been used for decades in drug discovery projects, especially for the finding of new compounds with therapeutic properties and the optimization of ADME properties on chemical series. The application of computational techniques in predictive...