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Journals in DBLP

Journal of Chemical Information and Computer Sciences
2002, volume: 42, number: 4

  1. Alexander Golbraikh, Danail Bonchev, Alexander Tropsha
    Novel ZE-Isomerism Descriptors Derived from Molecular Topology and Their Application to QSAR Analysis. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:769-787 [Journal]
  2. Simona Funar-Timofei, Gerrit Schüürmann
    Comparative Molecular Field Analysis (CoMFA) of Anionic Azo Dye-Fiber Affinities I: Gas-Phase Molecular Orbital Descriptors. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:788-795 [Journal]
  3. Li Xing, Robert C. Glen
    Novel Methods for the Prediction of logP, pKa, and logD. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:796-805 [Journal]
  4. Lars Carlsen, Dorte B. Lerche, Peter B. Sørensen
    Improving the Predicting Power of Partial Order Based QSARs through Linear Extensions. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:806-811 [Journal]
  5. Alexandre Varnek, Georges Wipff, Vitaly P. Solov'ev, A. F. Solotnov
    Assessment of the Macrocyclic Effect for the Complexation of Crown-Ethers with Alkali Cations Using the Substructural Molecular Fragments Method. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:812-829 [Journal]
  6. William L. Fitch, Malcolm McGregor, Alan R. Katritzky, Andre Lomaka, Ruslan Petrukhin, Mati Karelson
    Prediction of Ultraviolet Spectral Absorbance Using Quantitative Structure-Property Relationships. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:830-840 [Journal]
  7. Ludovic Kurunczi, Marius Olah, Tudor I. Oprea, Cristian Bologa, Zeno Simon
    MTD-PLS: A PLS-Based Variant of the MTD Method, 2. Mapping Ligand-Receptor Interactions. Enzymatic Acetic Acid Esters Hydrolysis. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:841-846 [Journal]
  8. Xavier Gironés, Lluís Amat, Ramon Carbó-Dorca
    Modeling Large Macromolecular Structures Using Promolecular Densities. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:847-852 [Journal]
  9. Antonija Lesar, Saa Prebil, Milan Hodoscek
    Enthalpy of the Gas-Phase CO2 + Mg Reaction from ab Initio Total Energies. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:853-857 [Journal]
  10. Biye Ren
    Novel Atomic-Level-Based AI Topological Descriptors: Application to QSPR/QSAR Modeling. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:858-868 [Journal]
  11. Mark T. D. Cronin, Aynur O. Aptula, John C. Dearden, Judith C. Duffy, Tatiana I. Netzeva, Hiren Patel, Philip H. Rowe, T. Wayne Schultz, Andrew P. Worth, Konstantinos Voutzoulidis, Gerrit Schüürmann
    Structure-Based Classification of Antibacterial Activity. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:869-878 [Journal]
  12. Brett A. Tounge, Lori B. Pfahler, Charles H. Reynolds
    Chemical Information Based Scaling of Molecular Descriptors: A Universal Chemical Scale for Library Design and Analysis. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:879-884 [Journal]
  13. Jeffrey W. Godden, Ling Xue, Douglas B. Kitchen, Florence L. Stahura, E. James Schermerhorn, Jürgen Bajorath
    Median Partitioning: A Novel Method for the Selection of Representative Subsets from Large Compound Pools. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:885-893 [Journal]
  14. Hubert Maehr
    Graphic Representation of Configuration in Two-Dimensional Space. Current Conventions, Clarifications, and Proposed Extensions1, 2. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:894-902 [Journal]
  15. Dimitris K. Agrafiotis, Walter Cedeño, Victor S. Lobanov
    On the Use of Neural Network Ensembles in QSAR and QSPR. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:903-911 [Journal]
  16. Yong-Jin Xu, Mark Johnson
    Using Molecular Equivalence Numbers To Visually Explore Structural Features that Distinguish Chemical Libraries. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:912-926 [Journal]
  17. Sung Jin Cho, Mark A. Hermsmeier
    Genetic Algorithm Guided Selection: Variable Selection and Subset Selection. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:927-936 [Journal]
  18. Doron Chema, Oren M. Becker
    A Method for Correlations Analysis of Coordinates: Applications for Molecular Conformations. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:937-946 [Journal]
  19. Ansgar Schuffenhauer, Jürg Zimmermann, Ruedi Stoop, Jan-Jan van der Vyver, Steffano Lecchini, Edgar Jacoby
    An Ontology for Pharmaceutical Ligands and Its Application for in Silico Screening and Library Design. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:947-955 [Journal]
  20. Suresh Babu Mekapati, Corwin Hansch
    On the Parametrization of the Toxicity of Organic Chemicals to Tetrahymena pyriformis. The Problem of Establishing a Uniform Activity. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:956-961 [Journal]
  21. Ronan Bureau, Cyril Daveu, Stéphane Lemaître, François Dauphin, Henriette Landelle, Jean-Charles Lancelot, Sylvain Rault
    Molecular Design Based on 3D-Pharmacophore. Application to 5-HT4 Receptor. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:962-967 [Journal]
  22. Kiyoshi Hasegawa, Hidetoshi Shindoh, Yasuhiko Shiratori, Tatsuo Ohtsuka, Yuko Aoki, Shigeyasu Ichihara, Ikuo Horii, Nobuo Shimma
    Cassette Dosing Approach and Quantitative Structure-Pharmacokinetic Relationship Study of Antifungal N-Myristoyltransferase Inhibitors. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:968-975 [Journal]
  23. John M. Quigley, Sarah M. Naughton
    The Interrelation of Physicochemical Parameters and Topological Descriptors for a Series of -Blocking Agents. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 2002, v:42, n:4, pp:976-982 [Journal]
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