Releases: yutakasi634/MolHandler.jl
Releases · yutakasi634/MolHandler.jl
v0.1.0
The first release of MolHandler.jl!
This supports the following features.
- Importing and exporting information of molecular structure or trajectory file, written by dcd, pdb, xyz format.
- Analyzing contact of imported trajectory.
- Handling the trajectory with periodic boundary conditions.
- Get fundamental information of each molecule (e.g. center of mass, radius of gyration, etc...).