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GitHub / ccr-cheng / enantiomer-differentiation-gnn

Explore current geometric GNNs' ability to differentiate enantiomer pairs ⌬

JSON API: https://repos.ecosyste.ms/api/v1/hosts/GitHub/repositories/ccr-cheng%2Fenantiomer-differentiation-gnn

Stars: 3
Forks: 0
Open Issues: 0

License: mit
Language: Python
Repo Size: 1.32 MB
Dependencies: 14

Created: 6 months ago
Updated: 28 days ago
Last pushed: 6 months ago
Last synced: 28 days ago

Topics: enantiomer, gnn, tensor-field-networks

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    Dependencies
    requirements.txt pypi