COMPUTER SYSTEM AND METHOD FOR CALCULATING ADME PROPERTIES
1447/DELNP/2004 A (1447/DELNP/2004)
Filed on 2004-05-27
Publication date 2007-02-09
The invention relates to a computer system and a method for calculating an ADME property of a substance, which comprises the following steps: a. input of molecular properties of said substance into a biophysical model, whereby said biophysical model describes a correlation between the molecular properties and the ADME property and b. output of the ADME property.
Applicant
BAYER TECHNOLOGY SERVICES GMBH
D-51368 LEVERKUSEN, GERMANY Germany
Inventor
WALTER SCHMITT,, JÖRG KELDENICH,, JANNIS BATOULIS,, MICHAEL BECK,, ROGER-MICHAEL BRUNNE,, THORSTEN BÌRGER,, THORSTEN PÖTTER,, FELIX REICHEL,, STEFAN WILLMANN,
International Information
Classification
G01N33/48
Publication number
WO 03/048720
Application date
2002-11-25
Application number
PCT/EP02/14150