ClogPalk: a method for predicting alkane/water partition coefficient Peter W. KennyCarlos A. MontanariIgor M. Prokopczyk OriginalPaper 05 June 2013 Pages: 389 - 402
Effect of pH and ligand charge state on BACE-1 fragment docking performance José L. DomÃnguezM. Carmen VillaverdeFredy Sussman OriginalPaper 03 May 2013 Pages: 403 - 417
IS-Dom: a dataset of independent structural domains automatically delineated from protein structures Teppei EbinaYuki UmezawaYutaka Kuroda OriginalPaper 29 May 2013 Pages: 419 - 426
The continuous molecular fields approach to building 3D-QSAR models Igor I. BaskinNelly I. Zhokhova OriginalPaper 30 May 2013 Pages: 427 - 442
Cheminformatics aspects of high throughput screening: from robots to models: symposium summary Y. Jane TsengEric MartinAnang A. Shelat OriginalPaper 01 May 2013 Pages: 443 - 453
An informatic pipeline for managing high-throughput screening experiments and analyzing data from stereochemically diverse libraries Carol A. MulrooneyDavid L. LahrAndrea De Souza OriginalPaper 13 April 2013 Pages: 455 - 468
Managing missing measurements in small-molecule screens Michael R. BrowningBradley T. CalhounS. Joshua. Swamidass OriginalPaper 13 April 2013 Pages: 469 - 478