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Journals in DBLP

Journal of Chemical Information and Computer Sciences
1999, volume: 39, number: 6

  1. Shinsaku Fujita, Nobuya Tanaka
    XyM Notation for Electronic Communication of Organic Chemical Structures. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:903-914 [Journal]
  2. Shinsaku Fujita
    XyM Markup Language (XyMML) for Electronic Communication of Chemical Documents Containing Structural Formulas and Reaction Schemes. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:915-927 [Journal]
  3. Peter Murray-Rust, Henry S. Rzepa
    Chemical Markup, XML, and the Worldwide Web. 1. Basic Principles. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:928-942 [Journal]
  4. J. Brecher
    Name=Struct: A Practical Approach to the Sorry State of Real-Life Chemical Nomenclature. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:943-950 [Journal]
  5. Shushen Liu, Hailing Liu, Zhining Xia, Chenzhong Cao, Zhiliang Li
    Molecular Distance-Edge Vector (): An Extension from Alkanes to Alcohols. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:951-957 [Journal]
  6. Tanaji T. Talele, Santosh S. Kulkarni, Vithal M. Kulkarni
    Development of Pharmacophore Alignment Models as Input for Comparative Molecular Field Analysis of a Diverse Set of Azole Antifungal Agents. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:958-966 [Journal]
  7. Dragan Amic, Dusanka Davidovic-Amic, Drago Beslo, Bono Lucic, Nenad Trinajstic
    Prediction of pK Values, Half-Lives, and Electronic Spectra of Flavylium Salts from Molecular Structure. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:967-973 [Journal]
  8. Eric S. Goll, Peter C. Jurs
    Prediction of the Normal Boiling Points of Organic Compounds from Molecular Structures with a Computational Neural Network Model. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:974-983 [Journal]
  9. Gilles Caporossi, Drago Cvetkovi, Ivan Gutman, Pierre Hansen
    Variable Neighborhood Search for Extremal Graphs. 2. Finding Graphs with Extremal Energy. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:984-996 [Journal]
  10. Ovanes G. Mekenyan, Dimitar Dimitrov, Nina Nikolova, Stoyan Karabunarliev
    Conformational Coverage by a Genetic Algorithm. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:997-1016 [Journal]
  11. Andrew Rusinko III, Mark W. Farmen, Christophe G. Lambert, Paul L. Brown, S. Stanley Young
    Analysis of a Large Structure/Biological Activity Data Set Using Recursive Partitioning. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1017-1026 [Journal]
  12. Ludmila Dolmatova, Valery Tchistiakov, Cyril Ruckebusch, Nathalie Dupuy, Jean-Pierre Huvenne, Pierre Legrand
    Hierarchical Neural Network Modeling for Infrared Spectra Interpretation of Modified Starches. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1027-1036 [Journal]
  13. Ernesto Estrada, Lissette Rodríguez
    Edge-Connectivity Indices in QSPR/QSAR Studies, 1. Comparison to Other Topological Indices in QSPR Studies. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1037-1041 [Journal]
  14. Ernesto Estrada
    Edge-Connectivity Indices in QSPR/QSAR Studies, 2. Accounting for Long-Range Bond Contributions. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1042-1048 [Journal]
  15. Chuanhao Wan, Peter de B. Harrington
    Self-Configuring Radial Basis Function Neural Networks for Chemical Pattern Recognition. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1049-1056 [Journal]
  16. Artem Cherkasov, Mats Jonsson
    Substituent Effects on Thermochemical Properties of C-, N-, O-, and S-Centered Radicals. Physical Interpretation of Substituent Effects. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1057-1063 [Journal]
  17. Gregory A. Bakken, Peter C. Jurs
    Prediction of Hydroxyl Radical Rate Constants from Molecular Structure. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1064-1075 [Journal]
  18. Giuseppina C. Gini, Marco Lorenzini, Emilio Benfenati, Paola Grasso, Maurizio Bruschi
    Predictive Carcinogenicity: A Model for Aromatic Compounds, with Nitrogen-Containing Substituents, Based on Molecular Descriptors Using an Artificial Neural Network. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1076-1080 [Journal]
  19. Eric S. Goll, Peter C. Jurs
    Prediction of Vapor Pressures of Hydrocarbons and Halohydrocarbons from Molecular Structure with a Computational Neural Network Model. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1081-1089 [Journal]
  20. Rama K. Mishra, Ying-Ting Lin, Shyi-Long Lee
    Quantum Chemical AM1 Treatment of the Circumscribing Algorithm: Fullerene Growth Mechanism. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1090-1093 [Journal]
  21. Rosana Vendrame, R. S. Braga, Y. Takahata, D. S. Galvão
    Structure-Activity Relationship Studies of Carcinogenic Activity of Polycyclic Aromatic Hydrocarbons Using Calculated Molecular Descriptors with Principal Component Analysis and Neural Network Methods. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1094-1104 [Journal]
  22. Chenzhong Cao, Shusheng Liu, Zhiliang Li
    On Molecular Polarizability: 2. Relationship to the Boiling Point of Alkanes and Alcohols. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1105-1111 [Journal]
  23. Luwei Zhao, Ping Li, Samuel H. Yalkowsky
    Predicting the Entropy of Boiling for Organic Compounds. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1112-1116 [Journal]
  24. Paulina Mata
    The CIP System Again: Respecting Hierarchies Is Always a Must. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1117-1118 [Journal]
  25. Mircea Braban, Iuliana Pop, Xavier Willard, Dragos Horvath
    Reactivity Prediction Models Applied to the Selection of Novel Candidate Building Blocks for High-Throughput Organic Synthesis of Combinatorial Libraries. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1119-1127 [Journal]
  26. Santosh S. Kulkarni, Vithal M. Kulkarni
    Structure Based Prediction of Binding Affinity of Human Immunodeficiency Virus-1 Protease Inhibitors. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1128-1140 [Journal]
  27. Prabha Venkatarangan, Anton J. Hopfinger
    Prediction of Ligand-Receptor Binding Free Energy by 4D-QSAR Analysis: Application to a Set of Glucose Analogue Inhibitors of Glycogen Phosphorylase. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1141-1150 [Journal]
  28. Anton J. Hopfinger, Andrea Reaka, Prabha Venkatarangan, José S. Duca, Shen Wang
    Construction of a Virtual High Throughput Screen by 4D-QSAR Analysis: Application to a Combinatorial Library of Glucose Inhibitors of Glycogen Phosphorylase b. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1151-1160 [Journal]
  29. Andrew R. Leach, John Bradshaw, Darren V. S. Green, Michael M. Hann, John J. Delany III
    Implementation of a System for Reagent Selection and Library Enumeration, Profiling, and Design. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1161-1172 [Journal]
  30. Jiansuo Wang, Luhua Lai, Youqi Tang
    Structural Features of Toxic Chemicals for Specific Toxicity. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1173-1189 [Journal]
  31. Marina Cocchi, Pier Giuseppe De Benedetti, Renato Seeber, Lorenzo Tassi, Alessandro Ulrici
    Development of Quantitative Structure-Property Relationships Using Calculated Descriptors for the Prediction of the Physicochemical Properties (nD, , bp, , ) of a Series of Organic Solvents. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1190-1203 [Journal]
  32. David B. Terry, Jessica L. Bader, Michael Messina
    Simulated Annealing Search Algorithm for the Determination of Activation Energies and Arrhenius Prefactors from Limited Experimental Kinetic Data. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1204-1210 [Journal]
  33. Hans Matter, Thorsten Pötter
    Comparing 3D Pharmacophore Triplets and 2D Fingerprints for Selecting Diverse Compound Subsets. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1211-1225 [Journal]
  34. J. Brecher
    Comment on "Exhaustive Generation of Organic Isomers, 5. Unsaturated Optical and Geometrical Stereoisomers and a New CIP Subrule". [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1226-1227 [Journal]
  35. M. Leonor Contreras, G. M. Trevisiol, J. Alvarez, G. Arias, Roberto Rozas
    Response to the Comment on "Exhaustive Generation of Organic Isomers. 5. Unsaturated Optical and Geometrical Stereoisomers and a New CIP Subrule". [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1228-1229 [Journal]
  36. Sunil Gupta, Manjit Singh, A. K. Madan
    Superpendentic Index: A Novel Topological Descriptor for Predicting Biological Activity [J. Chem. Inf. Comput. Sci 39, 272-277 (1999)]. [Citation Graph (0, 0)][DBLP]
    Journal of Chemical Information and Computer Sciences, 1999, v:39, n:6, pp:1230-1230 [Journal]
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