Quantum Fragment Methods

A Python package for quantum chemistry tailored toward fragment-based embedding and quantum algorithms for macromolecules.

• Early Project (1)

  1. All the early projects

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  Limited support experimental(1)

  1. All the experimental projects

  Interface Python(1)

  1. All the projects with Python interface

  Category Application(1)

  1. All the projects in the Application category

  Labels chemistry(1)

  1. All the projects labeled with chemistry

• URLs

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  Source code
  Reference paper

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Checkups

Check up	Importance	What is failing	Days left	Discussion
[Q03] Have a cap on the major version for the qiskit dependency	RECOMMENDATION	The qiskit requirement in the quantum-fragment-methods manifest in the repository allows a not-yet-released major version of Qiskit	171	Issue asking for the cap submitted https://github.com/qiskit-community/quantum-fragment-methods/issues/13, waiting for the fix · discussion

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Packages

pip-installable repo	Version	Requires Python	Declared in
quantum-fragment-methods	0.0.1	>=3.8	pyproject.toml

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Qiskit requirements

Declared in	Requires	V1	V2	Highest supported
repo quantum-fragment-methods	>=1.0.0			2.5.2