All pull requests

Pull requests

• Add option to use 64-bit rapidhash for MacOS build

  #104·msricher opened Mar 6, 2025Collaborator·

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  13

• Add Issue Templates for Bug Report, Feature Request, Documentation, and General Issues

  #93·q-pratz-chem opened Jan 9, 2025Collaborator·

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• NonSingletCI Class, AP1roGSDGeneralizedSen-o Wfn

  #92·q-pratz-chem opened Jan 9, 2025Collaborator·

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• #82 Update genciwfn.cpp

  #91·pm-235779 opened Jan 6, 2025·

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  4

• Fix wrong dependency (#86)

  #90·msricher opened Dec 13, 2024Collaborator·

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  1

  1

• Attempt to support MacOS

  #81·FanwangM opened Nov 2, 2024Contributor·

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• Fix type for Windows OS

  #80·FanwangM opened Oct 31, 2024Contributor·

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• Use cibuildwheel for building PyPI releases

  #79·FanwangM opened Oct 31, 2024Contributor·

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• Initial FanPT Implementation

  #70·carlosevmoura opened Jun 12, 2024Collaborator·

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  2

• Update constraints.py

  #69·Jonathan-Lindley opened Jun 12, 2024Collaborator·

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  1

• Add Q constraint

  #68·alnaba1 opened May 23, 2024Collaborator·

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• 48 pt2

  #67·Pavlo3P opened May 16, 2024Collaborator·

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  2

• [pre-commit.ci] pre-commit autoupdate

  #41·pre-commit-ci[bot] opened Apr 15, 2024Bot·

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• Adding RMSD

  #38·AlexandreDeCamargo opened Apr 9, 2024Collaborator·

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