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Jean-Pierre Doucet
2000 – 2009
- 2006
[j15]Igor V. Tetko, Vitaly P. Solov'ev, Alexey V. Antonov, Xiaojun Yao, Jean-Pierre Doucet, Bo Tao Fan, Frank Hoonakker, Denis Fourches, Piere Jost, Nicolas Lachiche, Alexandre Varnek: Benchmarking of Linear and Nonlinear Approaches for Quantitative Structure-Property Relationship Studies of Metal Complexation with Ionophores. Journal of Chemical Information and Modeling 46(2): 808-819 (2006)- 2004
- [j14]Xiaojun Yao, Annick Panaye, Jean-Pierre Doucet, Ruisheng Zhang, Haifeng Chen, Mancang Liu, Zhide Hu, Bo Tao Fan: Comparative Study of QSAR/QSPR Correlations Using Support Vector Machines, Radial Basis Function Neural Networks, and Multiple Linear Regression. Journal of Chemical Information and Modeling 44(4): 1257-1266 (2004)
- 2002
- [j13]Jianhua Yao, Bo Tao Fan, Jean-Pierre Doucet, Annick Panaye, Jianfeng Li, Chuantao Sun, Shengang Yuan: SIRS-SS: A System for Simulating IR/Raman Spectra, 2. Procedures and Performance. Journal of Chemical Information and Computer Sciences 42(2): 199-207 (2002)
- [j12]Y. H. Xiang, Mancang Liu, X. Y. Zhang, Ruisheng Zhang, Z. D. Hu, Bo Tao Fan, Jean-Pierre Doucet, Annick Panaye: Quantitative Prediction of Liquid Chromatography Retention of N-Benzylideneanilines Based on Quantum Chemical Parameters and Radial Basis Function Neural Network. Journal of Chemical Information and Computer Sciences 42(3): 592-597 (2002)
- 2001
- [j11]Jianhua Yao, Bo Tao Fan, Jean-Pierre Doucet, Annick Panaye, Shengang Yuan, Jianfeng Li: SIRS-SS: A System for Simulating IR/Raman Spectra. 1. Substructure/Subspectrum Correlation. Journal of Chemical Information and Computer Sciences 41(4): 1046-1052 (2001)
- 2000
- [j10]Michel Petitjean, Bo Tao Fan, Annick Panaye, Jean-Pierre Doucet: Ring Perception: Proof of a Formula Calculating the Number of the Smallest Rings in Connected Graphs. Journal of Chemical Information and Computer Sciences 40(4): 1015-1017 (2000)
1990 – 1999
- 1999
- [j9]Bo Tao Fan, Annick Panaye, Jean-Pierre Doucet: Comment on "Isomorphism, Automorphism Partitioning, and Canonical Labeling Can Be Solved in Polynomial-Time for Molecular Graphs". Journal of Chemical Information and Computer Sciences 39(3): 630-631 (1999)
- 1997
- [j8]Ovidiu Ivanciuc, Jean-Pierre Rabine, Daniel Cabrol-Bass, Annick Panaye, Jean-Pierre Doucet: 13C NMR Chemical Shift Prediction of the sp3 Carbon Atoms in the Position Relative to the Double Bond in Acyclic Alkenes. Journal of Chemical Information and Computer Sciences 37(3): 587-598 (1997)
- 1996
- [j7]Ovidiu Ivanciuc, Jean-Pierre Rabine, Daniel Cabrol-Bass, Annick Panaye, Jean-Pierre Doucet: 13C NMR Chemical Shift Prediction of sp2 Carbon Atoms in Acyclic Alkenes Using Neural Networks. Journal of Chemical Information and Computer Sciences 36(4): 644-653 (1996)
- [j6]Bo Tao Fan, Alain Barbu, Annick Panaye, Jean-Pierre Doucet: Detection of Constitutionally Equivalent Sites from a Connection Table. Journal of Chemical Information and Computer Sciences 36(4): 654-659 (1996)
- 1993
- [j5]Annick Panaye, Jean-Pierre Doucet, Bo Tao Fan: Topological approach of carbon-13 NMR spectral simulation: Application to fuzzy substructures. Journal of Chemical Information and Computer Sciences 33(2): 258-265 (1993)
- [j4]Jean-Pierre Doucet, Annick Panaye, E. Feuilleaubois, P. Ladd: Neural networks and carbon-13 NMR shift prediction. Journal of Chemical Information and Computer Sciences 33(3): 320-324 (1993)
- [j3]Bo Tao Fan, Annick Panaye, Jean-Pierre Doucet, Alain Barbu: Ring perception. A new algorithm for directly finding the smallest set of smallest rings from a connection table. Journal of Chemical Information and Computer Sciences 33(5): 657-662 (1993)
- 1990
- [j2]Jacques-Emile Dubois, G. Mathieu, P. Peguet, Annick Panaye, Jean-Pierre Doucet: Simulation of infrared spectra: an infrared spectral simulation program (SIRS) which uses DARC topological substructures. Journal of Chemical Information and Computer Sciences 30(3): 290-302 (1990)
1980 – 1989
- 1986
- [j1]Jacques-Emile Dubois, S. Y. Yue, Jean-Pierre Doucet: Grid stage modelling functions and molecular vector graphics. The Visual Computer 2(6): 367-378 (1986)
Coauthor Index
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last updated on 2012-12-02 21:32 CET by the dblp team