Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
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Updated
Jul 30, 2026 - C++
Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
Quantum chemistry program executor and IO standardizer (QCSchema).
Parsers and algorithms for computational chemistry logfiles
Python module for quantum chemistry
Semiempirical Extended Tight-Binding Program Package
Periodic table, physical constants, and molecule parsing for quantum chemistry.
Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
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