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PDBe CCDUtils: an RDKit-based toolkit for handling and analysing small molecules in the Protein Data Bank
by
Kunnakkattu, Ibrahim Roshan
,
Choudhary, Preeti
,
Pravda, Lukas
,
Nadzirin, Nurul
,
Smart, Oliver S.
,
Yuan, Qi
,
Anyango, Stephen
,
Nair, Sreenath
,
Varadi, Mihaly
,
Velankar, Sameer
Published in
Journal of cheminformatics
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Literature-based drug–drug similarity for drug repurposing: impact of Medical Subject Headings term refinement and hierarchical clustering
by
Das, Shyam Sundar
,
Ranjan, Pritish
,
Kunnakkattu, Ibrahim Roshan
Published in
Future medicinal chemistry
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