QSAR-derived affinity fingerprints (part 2): modeling performance for potency prediction
Sign Up to like & getrecommendations! Published in 2020 at "Journal of Cheminformatics"
DOI: 10.1186/s13321-020-00444-5
Abstract: Affinity fingerprints report the activity of small molecules across a set of assays, and thus permit to gather information about the bioactivities of structurally dissimilar compounds, where models based on chemical structure alone are often… read more here.
Keywords: derived affinity; affinity; qaffp; qsar derived ... See more keywords