pypi.org "molecular-electronic-structure" keyword
View the packages on the pypi.org package registry that are tagged with the "molecular-electronic-structure" keyword.
iodata 0.1.3
Python library for reading, writing, and converting computational chemistry file formats and gene...4 versions - Latest release: over 7 years ago - 1 dependent repositories - 95 downloads last month - 120 stars on GitHub - 2 maintainers
qc-iodata 1.0.0a5
Python Input and Output Library for Quantum Chemistry5 versions - Latest release: 7 months ago - 2 dependent packages - 597 downloads last month - 120 stars on GitHub - 3 maintainers
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computational-biology
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computational-chemistry
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computational-physics
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data-parsing
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file-conversion
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file-converter
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file-format-converter
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file-format-library
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file-formats
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input-output
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json-schema
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molecular-dynamics
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molecular-dynamics-simulation
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molecular-mechanics
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molecular-simulation
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quantum-chemistry
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quantum-chemistry-packages
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quantum-chemistry-programs
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theoretical-chemistry
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