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Ckpt path and helper scripts#3

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hdieckhaus merged 6 commits into
mainfrom
ckpt_path_and_helper_scripts
Apr 21, 2026
Merged

Ckpt path and helper scripts#3
hdieckhaus merged 6 commits into
mainfrom
ckpt_path_and_helper_scripts

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This PR does three main things:

  • Renames the mamba GPU environment from hbdesigner to hbdesigner_gpu to match the CPU environment.
  • Adds an option to specify a file path for model weights.
  • Adds helper scripts and example usage for common post processing operations and LigandMPNN downstream use.

@hdieckhaus hdieckhaus requested a review from rclune April 2, 2026 21:37
@hdieckhaus hdieckhaus merged commit 56d1ccd into main Apr 21, 2026
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@hdieckhaus hdieckhaus deleted the ckpt_path_and_helper_scripts branch April 21, 2026 14:16
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