BSD Portsscience/py-rmsd 1.6.3_1 DragonFly
Calculate root-mean-square deviation (RMSD) between coordinate sets
- System
- DragonFly
- Repository
- DPorts
- Maintainer
- [email protected] (as in FreeBSD)
- License
- BSD2CLAUSE
- Categories
- science
- Package size
- 40.2 KiB, 226.7 KiB installed
Description
Calculate Root-mean-square deviation (RMSD) of Two Molecules Using Rotation.
The root-mean-square deviation (RMSD) is calculated, using Kabsch algorithm (1976) or Quaternion algorithm (1991) for rotation, between two Cartesian coordinates in either .xyz or .pdb format, resulting in the minimal RMSD.
In the other systems
| System | Port | Version |
|---|---|---|
| DragonFly | science/py-rmsd | 1.6.3_1 |
| FreeBSD | science/py-rmsd | 1.7.0 |
| HardenedBSD | science/py-rmsd | 1.6.5 |
| GhostBSD | science/py-rmsd | 1.6.5 |
Install
Binary package:
pkg install py311-rmsdFrom DPorts:
cd /usr/dports/science/py-rmsd && make install clean