Application of descriptors based on Lipinski’s rules in the QSPR study of aqueous solubilities

Applied Regression Analysis

Technometrics · 2005 · 18.1K citations

Business, Biostatistics, Mathematics +17

Hydrophobicity and Central Nervous System Agents: On the Principle of Minimal Hydrophobicity in Drug Design

Corwin Hansch, J.P. Björkroth, Albert J. Leo · Journal of Pharmaceutical Sciences · 1987 · 435 citations

Pharmacy, Medicinal Chemistry, Pharmacology +14

Evolutionary Optimization in Quantitative Structure−Activity Relationship:  An Application of Genetic Neural Networks

Sung‐Sau So, Martin Karplus · Journal of Medicinal Chemistry · 1996 · 261 citations

Pharmacy, Medicinal Chemistry, Pharmacology +17

Solubility of nonelectrolytes in polar solvents. V. Estimation of the solubility of aliphatic monofunctional compounds in water using a molecular surface area approach

Gordon L. Amidon, Samuel H. Yalkowsky, Shabbir T. Anik et al. · The Journal of Physical Chemistry · 1975 · 151 citations

Natural Sciences, Chemistry, Analytical Chemistry +13

Comparative Regression Analysis. Regressions Based on a Single Descriptor

Milan Randić · Hrčak Portal of scientific journals of Croatia (University Computing Centre) · 1993 · 111 citations · Full text

Computing, Data Science, Feature Engineering +2