Marcus D. Hanwell

avogadro. Avogadro 1 is not under active development, the repository was archived in September 2021. Development of Avogadro 2 is being done at https://github.com/openchemistry/avogadrolibs. Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

avogadro-squared. Avogadro superbuild project, builds Avogadro dependencies and then Avogadro itself

eigen. Git conversion of the Eigen respository, largely for superbuild projects

openchemistry. Supermodule containing submodules and external project to build all components

openqube. Open quantum processing library, read output files, generate MOs and electron density cubes.

tomviz. Cross platform, open source application for the processing, visualization, and analysis of 3D tomography data

vtk-modularization. Scripts for VTK modularization

avogadro-swireengine. A simple wire engine plugin example project built against the installed Avogadro library

AvogadroVTK. Avogadro VTK extension, primarily using the volume rendering from VTK to look at electronic structure

avogadrolibs. Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

fox. A Fortran XML library

chemicaljson. Development of the Chemical JSON data representation

avogadroapp. Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.

avogadro-super. First attempt at a Git super project - contains Avogadro and OpenBabel

realm. Realm runtime system

velox. A C++ vectorized database acceleration library aimed to optimizing query engines and data processing systems.

VTK. Visualization Toolkit

blog. Source for my Hugo based blog

QUI. The Q-Chem User Interface