From: Joerg K. W. <we...@in...> - 2004-02-13 11:12:14
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Hi all, if you are interested in QSAR, here we go. All mentioned descriptor calculation methods are part of the actual JOELib distribution. So decide on your own if you like them. Part I - Data preparation and feature selection: http://dx.doi.org/10.1021/ci0342324 Part II - Human Intestinal Absorption: http://dx.doi.org/10.1021/ci034233w Regards, Joerg -- Dipl. Chem. Joerg K. Wegner Center of Bioinformatics Tuebingen (ZBIT) Department of Computer Architecture Univ. Tuebingen, Sand 1, D-72076 Tuebingen, Germany Phone: (+49/0) 7071 29 78970 Fax: (+49/0) 7071 29 5091 E-Mail: mailto:we...@in... WWW: http://www-ra.informatik.uni-tuebingen.de -- Never mistake motion for action. E. Hemingway |