TrixX: structure-based molecule indexing for large-scale virtual screening in sublinear time Ingo SchellhammerMatthias Rarey Original Paper 09 February 2007 Pages: 223 - 238
Using a pharmacophore representation concept to elucidate molecular similarity of dopamine antagonists V. AtlamazoglouT. ThireouE. Eliopoulos Original Paper 13 February 2007 Pages: 239 - 249
Optimization of biaryl piperidine and 4-amino-2-biarylurea MCH1 receptor antagonists using QSAR modeling, classification techniques and virtual screening Georgia MelagrakiAntreas AfantitisOlga Igglessi-Markopoulou Original Paper 22 March 2007 Pages: 251 - 267
Support vector inductive logic programming outperforms the naive Bayes classifier and inductive logic programming for the classification of bioactive chemical compounds Edward O. CannonAta AminiJohn B. O. Mitchell OriginalPaper 27 March 2007 Pages: 269 - 280
Surflex-Dock 2.1: Robust performance from ligand energetic modeling, ring flexibility, and knowledge-based search Ajay N. Jain OriginalPaper 27 March 2007 Pages: 281 - 306