- Fixed conda NetCDF issue on macOS. Yay for managing python environments!
- Install conda ambertools during setup.
- Search for bundled version of
sanderwhen running AMBER simulation processes.
- Pass executable found by BioSimSpace.MD to BioSimSpace.Process constructor.
- Fixed error in RMSD calculation within BioSimSpace.Trajectory class.
- Improved example scripts and notebooks.
2018.1.0 - May 01 2018¶
- Initial public release of BioSimSpace.