Ecosyste.ms: Awesome
An open API service indexing awesome lists of open source software.
Projects in Awesome Lists by grimme-lab
A curated list of projects in awesome lists by grimme-lab .
https://github.com/grimme-lab/dxtb
Efficient And Fully Differentiable Extended Tight-Binding
automatic-differentiation computational-chemistry pytorch quantum-chemistry tight-binding
Last synced: 24 Sep 2024
https://github.com/grimme-lab/qc2-teaching
Resources for teaching quantum chemistry courses in Bonn
educational fortran fortran-tutorial learning quantum-chemistry teaching
Last synced: 04 Aug 2024
https://github.com/grimme-lab/mctc-lib
Modular computation tool chain library
Last synced: 04 Aug 2024