Development of a Novel Fingerprint for Chemical Reactions...

Journal of Chemical Information and Modeling 2015 / 01 Vol. 55; Iss. 1

Development of a Novel Fingerprint for Chemical Reactions and Its Application to Large-Scale Reaction Classification and Similarity

Schneider, Nadine, Lowe, Daniel M., Sayle, Roger A., Landrum, Gregory A.
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Volume:
55
Language:
english
Journal:
Journal of Chemical Information and Modeling
DOI:
10.1021/ci5006614
Date:
January, 2015
File:
PDF, 3.21 MB
english, 2015
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