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applications/science/chemistry

Showing entries 1-6 out of 6.
autodock-vinaNix package
One of the fastest and most widely used open-source docking engines
avogadro2Nix package
Molecule editor and visualizer
nwchemNix package
Open Source High-Performance Computational Chemistry
One of the fastest and most widely used open-source docking engines
One of the fastest and most widely used open-source docking engines
quantum-espressoNix package
Electronic-structure calculations and materials modeling at the nanoscale