Additional file 6 of QSAR-derived affinity fingerprints (part 1): fingerprint construction and modeling performance for similarity searching, bioactivity classification and scaffold hopping
| Autor: | Škuta, C., Cortés-Ciriano, I., Dehaen, W., Kříž, P., Westen, G. J. P. Van, Tetko, I. V., Bender, A., Svozil, D. |
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| Rok vydání: | 2020 |
| DOI: | 10.6084/m9.figshare.12610144.v1 |
| Popis: | Additional file 6. Similarity searching and biological activity classification tasks. Plots showing the performance of the QAFFP and Morgan2 fingerprints. |
| Databáze: | OpenAIRE |
| Externí odkaz: |
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