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Journal of Chemical Information and Computer Sciences|June 21, 2001
Prediction of nonlinear optical responses of organic compoundsK Oberg, A Berglund, U Edlund, et al.Journal of Chemical Information and Computer Sciences|September 28, 2004
Partitioning of pi-electrons in rings of polycyclic conjugated hydrocarbons. 5. Nonalternant compoundsAlexandru T Balaban, Milan RandićJournal of Chemical Information and Computer Sciences|November 1, 1979
Using bibliometric analyses of patent literature for predicting the clinical fates of developing drugsD A WindsorJournal of Chemical Information and Computer Sciences|February 1, 1985
Chemical toxicology searching: a comparative study of online data-basesD Bawden, A M BrockJournal of Chemical Information and Computer Sciences|November 24, 2004
Molecules-in-molecule estimation of the extent of localization of Kekuléan substructures in polycyclic aromatic hydrocarbonsTetsuo Morikawa, Susumu Narita, Douglas J KleinJournal of Chemical Information and Computer Sciences|November 24, 2004
Representation of the molecular topology of cyclical structures by means of cycle graphs. 3. Hierarchical model of screening of chemical databasesIrene Luque Ruiz, Gonzalo Cerruela García, Miguel Angel Gómez-NietoJournal of Chemical Information and Computer Sciences|November 24, 2004
Accelerated K-means clustering in metric spacesAndrew SmellieJournal of Chemical Information and Computer Sciences|November 24, 2004
Active learning with support vector machine applied to gene expression data for cancer classificationYing LiuJournal of Chemical Information and Computer Sciences|November 24, 2004
Expanded interaction fingerprint method for analyzing ligand binding modes in docking and structure-based drug designMatthew D Kelly, Ricardo L ManceraJournal of Chemical Information and Computer Sciences|November 24, 2004
Ensemble methods for classification in cheminformaticsChristian Merkwirth, Harald Mauser, Tanja Schulz-Gasch, et al.Pageof 132