Examples using ParmEd to transform between different coordinate formats. This is an important part for the creation of tailored FF and automatic creation of Gromacs topology files.
ParmEd can be easily installed by typing:
pip install ParmEd| Name | Name | Last commit date | ||
|---|---|---|---|---|
Examples using ParmEd to transform between different coordinate formats. This is an important part for the creation of tailored FF and automatic creation of Gromacs topology files.
ParmEd can be easily installed by typing:
pip install ParmEd