Combining structural and bioactivity-based fingerprints...

Journal of Cheminformatics 2019 / 12 Vol. 11; Iss. 1

Combining structural and bioactivity-based fingerprints improves prediction performance and scaffold hopping capability

Laufkötter, Oliver, Sturm, Noé, Bajorath, Jürgen, Chen, Hongming, Engkvist, Ola
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Volume:
11
Language:
english
Journal:
Journal of Cheminformatics
DOI:
10.1186/s13321-019-0376-1
Date:
December, 2019
File:
PDF, 2.06 MB
english, 2019
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