Global versus local QSAR models for predicting ionic liquids toxicity against IPC-81 leukemia rat cell line: The predictive ability

Computer Aided Design of Experiments

R. W. Kennard, L. A. Stone · Technometrics · 1969 · 3.4K citations

Public Health, Design, Computer-aided Design +11

Principles of QSAR models validation: internal and external

Paola Gramatica · QSAR & Combinatorial Science · 2007 · 2.2K citations · Full text

Pharmacy, Medicinal Chemistry, Drug Design +13

Energy applications of ionic liquids

Douglas R. MacFarlane, Naoki Tachikawa, Maria Forsyth et al. · Energy & Environmental Science · 2013 · 1.7K citations · Full text

Natural Sciences, Chemistry, Materials Science +17

Toxicity and antimicrobial activity of imidazolium and pyridinium ionic liquids

Kathryn M. Docherty, Charles F. Kulpa · Green Chemistry · 2005 · 974 citations

Natural Sciences, Chemistry, Microbiology +12

On a simple approach for determining applicability domain of QSAR models

Kunal Roy, Supratik Kar, Pravin Ambure · Chemometrics and Intelligent Laboratory Systems · 2015 · 771 citations

Pharmacy, Medicinal Chemistry, Computational Chemistry +14