Welcome to my GitHub Pages.
I am a scientist working at the border between chemistry and physics. My main investigation tool is computer simulations. For this reason I am often developing scientific software, and some of it is now on github. Feel free to download and use my code: just, please, give credit where credit is due! If you are unsure on how to do that, drop me an email.
Some of my projects hosted on GitHub are:
- A Gromacs version with Gaussian charges
- ITIM/GITIM implementation for gromacs
- A flexible/efficient code to compute correlation functions
- A modification of the gromos 45a4 forcefield for carbohydrates, to reproduce puckering free energies
I am also contributing to ESPResSo with my GitHub fork
If you are looking for my scientific activity, visit one of the following pages:
Enjoy!