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Internet Electronic Conference of Molecular Design 2003
IECMD 2003, November 23 - December 6 IECMD 2003, Day 2, November 25
1. IECMD 2003, paper 22
On the Existence of the Butterfly Isomer of
Al2H2: Ab Initio Coupled-Cluster Study
Jerzy Moc and Maria Wierzejewska
2. IECMD 2003, paper 44
Convergence Improvement Of Two-electron
Four-center Coulomb And Exchange Integrals
Over Slater-Type Orbitals
Hassan Safouhi and Lilian Berlu
3. IECMD 2003, paper 23
Reaction Constants Derived from Activation Parameters
for the Evaluation of Substituent and Solvent Effects
Ferenc Ruff
4. IECMD 2003, paper 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, Géraldine Bouchard, Patrick Gaillard, Frédéric Billois, Patrizia Crivori, Philip G. Strange, and Bernard Testa
5. IECMD 2003, paper 2
TOPS-MODE Versus DRAGON Descriptors in QSAR. 1. Skin Permeation
Maykel Perez Gonzalez and Aliuska Morales Helguera
6. IECMD 2003, paper 58
An application of Multi-variate adaptive
regression splines (MARS) in QSRR
R. Put, D.L. Massart, and Y. Vander Heyden
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