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improve parsing script using pydantic
Python CI
#59:
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2c37131
pushed by
InesZenati
37s
ines/grodecoder
ines/grodecoder
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add parse_itp.py and parse_rtp.py
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ines/grodecoder
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Merge pull request #114 from MDverse/feature/new-guess-resolution
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ines/grodecoder
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Merge branch 'main' into develop
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#56:
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develop
develop
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Merge branch 'main' into develop
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Merge pull request #114 from MDverse/feature/new-guess-resolution
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Feature/new guess resolution
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Merge branch 'main' into feature/new-guess-resolution
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Merge branch 'feature/new-guess-resolution' of github.com:MDVerse/gro…
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Merge branch 'feature/new-guess-resolution' of github.com:MDVerse/gro…
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tests/test_guesser.py: fixes english mistake in comment
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minor fix: spelling issue: distance_cutoff -> cutoff_distance
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new MolecularResolution class: update regression test dataset
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upgrade dependencies
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fixes minor type hinting issue
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fixes minor type hinting issue
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Minor sanity fixes
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fixes minor type hinting issue
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upgrade dependencies: urllib3, protobuf
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