Substructure Search is a computational method in qualitative structure-activity relationship studies that identifies molecules containing a specified molecular fragment or pattern by systematically comparing subgraph structures within a chemical database.
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Substructure Searching
Publications
399
LMSD: LIPID MAPS structure database
Manish Sud, Eoin Fahy, David Cotter et al. · Nucleic Acids Research · 2006 · 1.4K citations · Full text
1–5 of 399
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- PW
11
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- LBLawrence B. Holder
The University of Texas at Arlington, United States
11 publications · 928 citations
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- MR
7
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- JB
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Centre National de la Recherche Scientifique
Paris, France
15 h-index
400 publications
22.1K citations
University of Sheffield
Sheffield, United Kingdom
14 h-index
78 publications
5.9K citations
The University of Texas at Arlington
Arlington, United States
12 h-index
56 publications
4K citations
University of Bonn
Bonn, Germany
11 h-index
117 publications
7.4K citations
University of Cambridge
Cambridge, United Kingdom
10 h-index
46 publications
2.6K citations
Universität Hamburg
Hamburg, Germany
9 h-index
59 publications
3.2K citations
Chinese Academy of Sciences
Beijing, China
9 h-index
52 publications
2.3K citations
The Ohio State University
Columbus, United States
8 h-index
44 publications
2K citations
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- Journal of Chemical Information and Modeling
JCIM · 46 publications · 2.9K citations
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- Journal of Chemical Information and Computer Sciences
46 publications · 4.8K citations
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- Journal of Medicinal Chemistry
13 publications · 1.4K citations
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- Journal of Cheminformatics
14 publications · 637 citations
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- Bioinformatics
14 publications · 874 citations
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