intermol.gromacs.grofile_parser module¶
- class intermol.gromacs.grofile_parser.GromacsGroParser(gro_file)[source]¶
Bases: object
GromacsGroParser reads and writes Gromacs .gro files
A .gro file also contains some topological information, such as elements and residue names, but not enough to construct a full Topology object. This information is recorded and stored in the object’s public fields.