Additional file 4 of SYBA: Bayesian estimation of synthetic accessibility of organic compounds
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https://figshare.com/articles/dataset/Additional_file_4_of_SYBA_Bayesian_estimation_of_synthetic_accessibility_of_organic_compounds/12344633
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资源简介:
Additional file 4. Computationally picked test set (TCP). It consists of 3 581 HS compounds that were obtained from the GDB-17 database complemented by the same number of compounds randomly selected from the ZINC15 database.
创建时间:
2020-05-20



