Releases: gVallverdu/pychemcurv
Releases · gVallverdu/pychemcurv
Release 2022.3.16
This new version splits the pychemcurv
library and the web application. The later moves to a separated repository https://github.com/gVallverdu/pychemcurv-app
Release 2020.6.3
This new version includes
- The dash app, available online at https://pychemapps.univ-pau.fr/mosaica/
- The
CurvatureViewer
class to visualize structure and atomic properties with nglview - notebooks are available on binder
First stable version
This is the first stable version with everything up to date.
VertexAtom
andHybridization
classes to perform local geometry analyses on one centerCurvatureAnalyzer
class to perform analyzes on a complete molecular or periodic systemCurvatureViewer
class to visualize the structure and map properties using a colorscale
The classes can be installed using setup.py