GitHub - tetrahedroid/graphene-studio: Design of graphenes.

Name		Name	Last commit message	Last commit date
Latest commit History 22 Commits
graphenestudio		graphenestudio
oplsaa.ff		oplsaa.ff
.gitignore		.gitignore
4Pice-atomtypes.itp		4Pice-atomtypes.itp
4Pice.itp		4Pice.itp
Makefile		Makefile
README.ipynb		README.ipynb
README.md		README.md
README2.ipynb		README2.ipynb
ToDo.md		ToDo.md
cnt.itp		cnt.itp
continue-solvated-fullfix.mdp		continue-solvated-fullfix.mdp
graphene.top		graphene.top
gromacs.py		gromacs.py
initial-graphene.mdp		initial-graphene.mdp
initial-solvated-fullfix.mdp		initial-solvated-fullfix.mdp
initial-solvated.mdp		initial-solvated.mdp
pbcfix.py		pbcfix.py
poetry.toml		poetry.toml
pyproject.toml		pyproject.toml
restrain.py		restrain.py
run.py		run.py
solvated-fullfix.top		solvated-fullfix.top
solvated.top		solvated.top
split.py		split.py
tip4p.top		tip4p.top