gbyuvd/chemembed-chemselfies

https://huggingface.co/gbyuvd/chemembed-chemselfies
Idleby gbyuvd1181updated 10 months ago
Python

ChemFIE-BED is a sentence-transformers based on gbyuvd/chemselfies-base-bertmlm fine-tuned on around (for now) 2 million pairs of valid molecules' SELFIES (Krenn et al. 2020) taken from COCONUTDB (Sorokina et al. 2021) and ChemBL34 (Zdrazil et al. 2023).

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