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Add basic version reporting #480

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Add basic version reporting #480

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46ef8c8
include version number into help text and add --version flag
Jnelen Jul 14, 2025
760d144
print Boltz version at CLI entry point
Jnelen Jul 14, 2025
a9aa3da
Merge branch 'jwohlwend:main' into versioning
Jnelen Jul 15, 2025
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8 changes: 5 additions & 3 deletions src/boltz/main.py
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Original file line number Diff line number Diff line change
Expand Up @@ -33,6 +33,8 @@
from boltz.model.models.boltz1 import Boltz1
from boltz.model.models.boltz2 import Boltz2

from boltz import __version__

CCD_URL = "https://huggingface.co/boltz-community/boltz-1/resolve/main/ccd.pkl"
MOL_URL = "https://huggingface.co/boltz-community/boltz-2/resolve/main/mols.tar"

Expand Down Expand Up @@ -807,10 +809,10 @@ def process_inputs(
manifest.dump(out_dir / "processed" / "manifest.json")


@click.group()
@click.group(help=f"Boltz v{__version__}")
@click.version_option(__version__)
def cli() -> None:
"""Boltz."""
return
click.echo(f"Boltz v{__version__}")


@cli.command()
Expand Down