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GitHub · Drug discovery and cheminformatics

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1

Biohub ESMFold2 / ESMFold2-Fast all-atom co-folding (Candido et al.

JimLiu/science-skills2284 repos~2.5kAutomated safety check: PassApache-2.03 mo ago
2

Predict small-molecule binding poses with DiffDock-L (Corso et al.

JimLiu/science-skills2284 repos~1.1kAutomated safety check: PassApache-2.03 mo ago
3

Structure prediction for protein, nucleic-acid, and small-molecule complexes with Boltz-2 (Passaro & Wohlwend et al.

JimLiu/science-skills2284 repos~1.3kAutomated safety check: PassApache-2.03 mo ago
4

Structure prediction for protein, nucleic-acid, and small-molecule complexes with the Chai-1 foundation model (Chai Discovery 2024, github.com/chaidiscovery/chai-lab).

JimLiu/science-skills2284 repos~1.2kAutomated safety check: PassApache-2.03 mo ago