Optimizing the performance of in silico ADMET general models according to local requirements: MARS approach. solubility estimations as case study. [electronic resource]
- Journal of chemical information and modeling Dec 2009
- 2837-50 p. digital
Publication Type: Journal Article
1549-960X
10.1021/ci900308u doi
Absorption Computational Biology--methods Drug Discovery High-Throughput Screening Assays Monte Carlo Method Reproducibility of Results Solubility