BioExcel
Center of Excellence for Computational Biomolecular Research
Popular repositories Loading
-
-
gromacs-2022-cp2k-tutorial
gromacs-2022-cp2k-tutorial PublicSample inputs and tutorial for GROMACS-2022/CP2K QMMM interface
-
cp2K_qmmm_tutorials_for_biological_simulations
cp2K_qmmm_tutorials_for_biological_simulations PublicSeveral QM/MM tutorials for biological simulations adapted to CP2K. Tutorials adapted from AMBER, GMX, NAMD and CPMD softwares.
-
Repositories
Showing 10 of 117 repositories
- biobb_flexserv Public
Biobb_flexserv is a BioBB category for biomolecular flexibility studies on protein 3D structures.
bioexcel/biobb_flexserv’s past year of commit activity - biobb_flexdyn Public
biobb_flexdyn is a BioBB category for studies on the conformational landscape of native proteins.
bioexcel/biobb_flexdyn’s past year of commit activity - biobb_adapters Public
Biobb_adapters is the Biobb module collection to use the building blocks with several workflow managers.
bioexcel/biobb_adapters’s past year of commit activity - biobb_cp2k Public
bioexcel/biobb_cp2k’s past year of commit activity - biobb_cmip Public
bioexcel/biobb_cmip’s past year of commit activity - biobb_pdb_tools Public
bioexcel/biobb_pdb_tools’s past year of commit activity - biobb_gromacs Public
bioexcel/biobb_gromacs’s past year of commit activity