Software Open Access
akohlmey/topotools: Release 1.7
Axel Kohlmeyer; Josh Vermaas
TopoTools version 1.7 was released with VMD 1.9.3 and contains the following changes:
- better error handling in several places
- print out a reminder with DOIs for how to cite TopoTools and TopoGromacs when used for the first time
- auto-detection of atom styles for reading LAMMPS data files with style hints
- support for incompatible atoms styles
dpdandhybridis removed and support forsphereadded - bugfix for logic bug in detecting Nickel atoms from their mass
- add several missing sub-command references for sorting lists of angles, dihedrals and impropers
Files
(53.6 kB)
| Name | Size | |
|---|---|---|
|
akohlmey/topotools-v1.7.zip
md5:1470bed0ea70d4ced0f7288d3734a088 |
53.6 kB | Download |
1,959
330
views
downloads
| All versions | This version | |
|---|---|---|
| Views | 1,959 | 1,113 |
| Downloads | 330 | 161 |
| Data volume | 18.3 MB | 8.6 MB |
| Unique views | 1,727 | 1,008 |
| Unique downloads | 279 | 156 |
Available in
Indexed in
Indexed in
- Publication date:
- April 11, 2017
- DOI:
-
- Related identifiers:
- Supplement to
- License (for files):
- Other (Open)