Similarity searching using compound class-specific combinations of substructures found in randomly generated molecular fragment populations.
作者信息
Batista José, Bajorath Jürgen
机构信息
Department of Life Science Informatics, Bonn-Aachen International Center for Information Technology, Rheinische Friedrich-Wilhelms-Universität Bonn, Dahlmannstr. 2, 53113 Bonn, Germany.
出版信息
ChemMedChem. 2008 Jan;3(1):67-73. doi: 10.1002/cmdc.200700199.
PMID:17952883
Abstract
摘要
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