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QCxMS2
QCxMS2 PublicForked from grimme-lab/QCxMS2
Program package for the quantum mechanical calculation of EI mass spectra using automated reaction network exploration
Fortran 1
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crest
crest PublicForked from crest-lab/crest
CREST - A program for the automated exploration of low-energy molecular chemical space.
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MindlessGen
MindlessGen PublicForked from grimme-lab/MindlessGen
Mindless molecule generator in a Python package.
Python
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