Journal: Journal of Computer-Aided Molecular Design

Volume 20, Issue 4

191 -- 208Roger A. Sayle, Anthony Nicholls. Electrostatic evaluation of isosteric analogues
209 -- 225Kathleen M. Gilbert, Carol A. Venanzi. Hierarchical clustering analysis of flexible GBR 12909 dialkyl piperazine and piperidine analogs
227 -- 236Toni Rönkkö, Anu J. Tervo, Jussi Parkkinen, Antti Poso. BRUTUS: Optimization of a grid-based similarity function for rigid-body molecular superposition. II. Description and characterization
237 -- 248Yoshifumi Fukunishi, Satoru Kubota, Chisato Kanai, Haruki Nakamura. A Virtual Active Compound Produced from the Negative Image of a Ligand-binding Pocket, and its Application to in-silico Drug Screening
249 -- 261Sung Jin Cho, Yaxiong Sun, William Harte. ADAAPT: Amgen's data access, analysis, and prediction tools