Multi-Fingerprint Dataset
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资源简介:
This dataset contains 24 molecular fingerprints calculated for a large set of structures taken from MCULE, SAVI, DUDE, LITPCBA, DEKOIS and MUV. Each zip file contains different fingerprints calculated for the molecules in the database. Each file is a CSV file starting with the molecule name/ID and followed by a string of 0s and 1s.
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Zenodo创建时间:
2021-10-07



