Code

Feature/hbond#64

Code

Merged

ysyecust merged 7 commits intomaindptech-corp/Uni-Dock:mainfrom feature/Hbonddptech-corp/Uni-Dock:feature/HbondCopy head branch name to clipboardJan 18, 2024

+188-92

Commits

Commits on Jan 14, 2024

• add H bond support in precalculate_gpu

  ysyecust

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  ee0478d

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Commits on Jan 17, 2024

• fix: add ad atom type number

  ysyecust

  committed
  563c2f0

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• fix: donor type

  ysyecust

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  e96b67d

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Commits on Jan 18, 2024

• format code

  ysyecust

  committed
  72668ea

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• fix cpu H bond eval

  ysyecust

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  6b3e806

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• Merge branch 'main' into feature/Hbond

  ysyecust

  committed
  2a4d4e1

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• fix: H atom type error

  ysyecust

  committed
  75c9064

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