Examples
=========
The example section has grown (and it is expected to grow further). You can find them in the main github repository, here_ .
.. _here: https://github.com/MMunibas/Asparagus/tree/main/examples
Some examples are:
- Argon in Water
- Hexaaquairon3
- Diffusion Monte Carlo for NH3.
- Use of VP2.
- Zundel complex sampling with Metadynamics
- Examples of capacities with NH3:
- Calculator
- Model
- OpenMM
- Pycharmm
- Full example with PBE
A couple of tutorials to set up the reference calculation and different sampling methodologies can be found in this folder_.
.. _folder: https://github.com/MMunibas/Asparagus/tree/main/tutorials