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Commits on Oct 5, 2024

• Convert type

  lukasturcani

  committed
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• Merge remote-tracking branch 'origin/master'

  lukasturcani

  committed
  7765a37

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• Fix deps

  lukasturcani

  committed
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Commits on Oct 3, 2024

• Add partial charges method (#186)

  lukasturcani

  authored
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Commits on Aug 29, 2024

• Update authors

  lukasturcani

  committed
  11f9c60

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• Fix deps

  lukasturcani

  committed
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Commits on Aug 28, 2024

• Add dep

  lukasturcani

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• OpenMM (#185)

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  lukasturcani

  and

  andrewtarzia

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Commits on Jul 30, 2024

• Add kabsch rmsd and dependancy. (#180)

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  andrewtarzia

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Commits on Jul 24, 2024

• Add SASA collection to xtb and minor fixes. (#179)

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  andrewtarzia

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Commits on Jul 4, 2024

• Fix lints (#177)

  lukasturcani

  authored
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Commits on May 15, 2024

• Merge pull request #175 from lukasturcani/lukas/optimizer

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• thing

  lukasturcani

  committed
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• stuff

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Commits on Apr 26, 2024

• wip

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• wip

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  committed
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• wip

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• add stuff

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• wip

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• wip

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• wip

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• done

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Commits on Apr 25, 2024

• wip

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  committed
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• wip

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  dcc1c66

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• add thing

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• delete

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• Add thing

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• wip

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• wip

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• wip

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• add

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• wip

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• improve

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• improbe

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