“…The reduced pool of descriptors was scaled, and models were built using genetic algorithm (GA) optimization technique which aims to find the best combination of variables without exploring all of them. As GA is self-adaptive and self-learning, it is highly efficient at searching a subset of features to find optimal combinations, especially when the search space is large (Johnson et al, 2014;Minghua, Qingxian, Benda, & Feng, 2017). GA was coupled with the MLR fitness evaluator in the QSARINS program (QSAR-INSUBRIA; www.qsar.it; Gramatica, Cassani, & Chirico, 2014;Gramatica, Chirico, Papa, Cassani, & Kovarich, 2013).…”