ADMETox publications

A. R. Katritzky, M. Kuanar, D. C. Fara, M. Karelson, W. E. Acree, Jr., V. P. Solov’ev, A. Varnek
QSAR Modeling of Blood:Air and Tissue:Air Partition Coefficients Using Theoretical Descriptors
Bio-organic Medicinal Chemistry, 2005, 13 (23), 6450-6463.

A. R. Katritzky, M. Kuanar, S. Slavov, D.A. Dobchev, D. C. Fara, M. Karelson, W. E. Acree, Jr., V. P. Solov’ev, A. Varnek
Correlation of Blood: Brain Barrier Permeation Using Structural Descriptors.
Bioorganic & Medicinal Chem., 2006, 14, 4888-4917.

A. R. Katritzky, D.A. Dobchev, D. C. Fara, E. Hür, K. Tämm, L. Kurunczi, M. Karelson, V. P. Solov’ev, A. Varnek
Skin Permeation Rate as a Function of Chemical Structure.
J. Med. Chem, 2006, 49, 3305-3314.