Hello Michal,
you are probably referring to the Dragon Descriptors
(https://chm.kode-solutions.net/products_dragon.php, now called
alvaDesc)? That is a pretty comprehensive set of more than 5.000
descriptors and I would be surprised of someone had (re-)implemented all
of them.
The closest thing that I am aware of would be Mordred
(https://github.com/mordred-descriptor).
Hope this helps,
Nils
Am 10.11.2020 um 23:11 schrieb Michal Krompiec:
Hello RDKitters,
Are Dragon fingerprints (or something close) available in RDKit (or free
codes that depend on RDKit)? I'm trying to reproduce results from one paper.
Thanks,
Michal Krompiec
Merck KGaA
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