Publications about Proteochemometrics service

For publication of results, please cite:

Karasev, D., Sobolev, B., Lagunin, A., Filimonov, D., Poroikov, V., 2020b. Prediction of protein-ligand interaction based on sequence similarity and ligand structural features. Int. J. Mol. Sci. 21, 8152

Karasev, D., Sobolev, B., Lagunin, A., Filimonov, D., Poroikov, V., 2020a. Prediction of protein-ligand interaction based on the positional similarity scores derived from amino acid sequences. Int. J. Mol. Sci. 21, 24

Filimonov, D.A., Lagunin, A.A., Gloriozova, T.A., Rudik, A.V., Druzhilovskii, D.S., Pogodin, P.V., Poroikov, V.V., 2014. Prediction of the biological activity spectra of organic compounds using the PASS online web resource. Chem. Heterocycl. Comp. 50, 444–457

Filimonov, D., Poroikov, V. 2008. Chapter 6. Probabilistic approaches in activity prediction, in: Varnek, A., Tropsha, A, (Eds.), Chemoinformatics Approaches to Virtual Screening. RSC Publishing, London, pp. 182 –216