macrocosm-os / folding

Decentralized Protein Folding Bittensor Subnet
https://www.macrocosmos.ai/sn25
MIT License
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added unfolding of proteins to the pdb preprocessing #232

Open Sarkosos opened 1 month ago

Sarkosos commented 1 month ago

An initial implementation of the unfolding of proteins into our codebase, how we handle this can change later.

there's currently an issue with the implementation because saving the unfolded pdb doesn't save the PBC (line that starts with CRYST). Should be an easy fix though