AW: QSAR - electron density based superposition

Dear Dr. Borosy

Such a program called "Gafit" exists. This program is still in the
research stadium. Please contact me.

Please have also a look at the program SEAL from Kearsley and Smith.

With best regards,
Alexander Kos

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-----Ursprüngliche Nachricht-----
Von: qsar_society-admin,accelrys.com
[mailto:qsar_society-admin=-¬celrys.com] Im Auftrag von
Andras.Borosy[*]givaudan.com
Gesendet: Freitag, 23. Januar 2004 13:12
An: Computational Chemistry List
Betreff: QSAR - electron density based superposition

NB: Unless you reset the To: line, your reply goes to the entire list

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Dear Colleagues,
Does a (validated) computer application exist which can align molecules 
based on their electron density?
Many thank,
András Borosy
PhD Computational Chemist
Givaudan Schweiz AG
Fragrance Research
Ueberlandstr. 138
8600 Dübendorf
Switzerland
tel: + 41-1-8242164
fax: +41-1-8242926
e-mail: andras.borosy[#]givaudan.com
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