lammps-pdb-tools

Collection of lammps / PDB tools constructed during 2022 MITACS Internship

Name		Name	Last commit message	Last commit date
Latest commit History 5 Commits
example_run		example_run
LICENSE		LICENSE
README.md		README.md
charmm2lammpsgomodel.sh		charmm2lammpsgomodel.sh
contact_map_from_ch2lmp_pdb_2_0.py		contact_map_from_ch2lmp_pdb_2_0.py
cv_loop_2_0.ipynb		cv_loop_2_0.ipynb
get_term_size.sh		get_term_size.sh
interactive.pbs		interactive.pbs
log_parser3.sh		log_parser3.sh
make_thermo_gnu.sh		make_thermo_gnu.sh
thermo.p		thermo.p

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