computational-chemistryresearch
drugsda-mol-similarity
Compute the Tanimoto similarities between a target molecule and a list of candidate molecules using Morgan fingerprints.
maintainer
InternScience
Actualizado 2/27/2026
Estrellas
129
Forks
7
quick start
Installation and usage
Compute the Tanimoto similarities between a target molecule and a list of candidate molecules using Morgan fingerprints.
Instalación
$ install --globalskills.sh
Uso
Después de instalarlo, puedes usar este skill ejecutando el siguiente comando en tu terminal:
skills use drugsda-mol-similarity