Hi,
Please find enclosed the list of QSAR papers scheduled
for discussion during the first week of IECMD 2003,
the Internet Electronic Conference of Molecular Design 2003,
November 23 - December 6, http://www.biochempress.com
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Send a confidential comment about a paper to: iejmd*_*yahoo.com ; your comments
will be distributed to the iecmd2003 group, but your identity will not be
revealed.
November 24, 2003 / Monday
18. Computer-Aided Design of Selective COX-2 Inhibitors: Molecular Docking
of Structurally Diverse Cyclooxygenase-2 Inhibitors using FlexX Method
Asit K. Chakraborti and Ramasamy Thilagavathi
November 25, 2003 / Tuesday
23. Reaction Constants Derived from Activation Parameters for the Evaluation of
Substituent and Solvent Effects
Ferenc Ruff
52. A graphical similarity function to help ligand docking to proteins
based on the Molecular Lipophilicity Potential. The case of the
D2 dopamine receptor
Pierre-Alain Carrupt, Isabelle Raynaud, David McLoughlin, Geraldine Bouchard,
Patrick Gaillard, Frederic Billois, Patrizia Crivori,
Philip G. Strange, and Bernard Testa
2. TOPS-MODE Versus DRAGON Descriptors in QSAR. 1. Skin Permeation
Maykel Perez Gonzalez and Aliuska Morales Helguera
58. An application of Multi-variate adaptive regression splines (MARS) in QSRR
R. Put, D.L. Massart, and Y. Vander Heyden
November 26, 2003 / Wednesday
24. Classification of Polar and Nonpolar Aquatic Pollutants
Using Simple Descriptors. Differences between Polarity Prediction and
Narcosis Classification
Guido Sello
37. Ligand-based Computation of HIV-1 Integrase Inhibition Strength within
a Series of beta-ketoamide Derivatives
Frederik F. D. Daeyaert, H. Maarten Vinkers, Marc R. de Jonge, Jan Heeres,
Lucien M. H. Koymans, Paul J. Lewi, and Paul A. J. Janssen
51. Quantitative Structure-Electrochemistry Relationship Study of Some
Organic Compounds Using PC-ANN and PCR
Bahram Hemmateenejad and Mojtaba Shamsipur
November 27, 2003 / Thursday
3. TOPS-MODE Versus DRAGON Descriptors in QSAR. 2. Chromatographic Properties
Maykel Perez Gonzalez and Aliuska Morales Helguera
36. Holographic Quantitative Structure-Activity Relationship for Prediction
Acute Toxicity of Benzene Derivatives to the Guppy (Poecilia reticulata)
Huang Hong, Wang Xiao-Dong, Dai Xuan-Li, Yue Ya-Juan, and Wang Lian-Sheng
62. An Ant Colony Optimization Algorithm Classifier System for Bacterial Growth
P. S. Shelokar, V. K. Jayaraman, and B. D. Kulkarni
November 28, 2003 / Friday
4. Quantitative Structure-Activity Relationship Study of Bisphosphonates
Aihua Xie, Chenzhong Liao, Zhibin Li, Zhiqiang Ning, Weiming Hu, Xianping Lu,
Leming Shi, and Jiaju Zhou
25. 3D-QSAR of Protein Tyrosine Phosphatase 1B Inhibitors by Genetic
Function Approximation
Sree M. Vadlamudi and Vithal M. Kulkarni
Regards,
Ovidiu Ivanciuc
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Received on 2003-11-25 - 21:09 GMT
This archive was generated by hypermail 2.2.0 : 2005-11-24 - 10:21 GMT