Computational approaches to determine drug solubility
Bernard Faller(Novartis (Switzerland)), Peter Ertl(TU Wien)
Cited by 169
Related Papers
Fast Calculation of Molecular Polar Surface Area as a Sum of Fragment-Based Contributions and Its Application to the Prediction of Drug Transport Properties
|Journal of Medicinal Chemistry|2000|3k
Estimation of synthetic accessibility score of drug-like molecules based on molecular complexity and fragment contributions
|Journal of Cheminformatics|2009|1.9k
Virtual Computational Chemistry Laboratory – Design and Description
|Journal of Computer-Aided Molecular Design|2005|1.5k
Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information
|Journal of Computer-Aided Molecular Design|2011|686
Charting biologically relevant chemical space: A structural classification of natural products (SCONP)
|Proceedings of the National Academy of Sciences|2005|552