Project Filelist for nMOLDYN
File Release Notes and Changelog
Release Name: 3.0.0
No release notes
Change Log
This is nMOLDYN version 3.0.0.
Many changes from the last official release (2.2.5):
- global reorganization of the code
- brand new graphical user interface
- new plotting engine
- new trajectory converters
- new netCDF and ASCII converters
- preferences settings
- embedded documentation (HTML and PDF formats)
- embedded API (HTML and PDF formats)
- embedded analysis benchmark
- online access to the mailing list
- job status
and many new analysis:
- Root Mean Square Deviation
- Radius Of Gyration
- Global Motion Filtered Trajectory
- Center Of Mass Trajectory
- Quasi Harmonic Analysis
- Static Coherent Structure Factor
- Radial Distribution Function
- Coordination Number
- ScrewFit Analysis
- NMR Order parameter
- NMR Order Parameter using Contact Model