# CRYSTAL MET

<a href="url"><img src="https://github.com/NehZio/Crystal-MET/blob/master/images/fig4.png" align="left" height="400" width="400" ></a>                        

<a href="url"><img src="https://github.com/NehZio/Crystal-MET/blob/master/images/fig3.png" align="left" height="400" width="400" ></a>


Crystal MET (Crystal Maker Effective Tool) is a python3 programs, developped during an internship at the [LCPQ](www.lcpq.ups-tlse.fr) that helps you building a system using only the informations taken from a CIF file.

Use it with care, always check the output, it may work differently from what you expect.

I'm not responsible of a missuse of the results given, neither am I of any collateral such as your computer bursting into flame or any physical incident that could result of an improper use of this tool.

## Dependencies

Crystal MET uses :

* Scipy
* Numpy

## Use

`python3 crystal_met.py INPUT_FILE`


## Performances 

The calculation increases exponentially as you increase the number of atoms in the system you want.
Here are the results of some tests I made :

![graph1](/images/fig1.png) ![graph2](/images/fig2.png)

 ## Contact
 
 If you find any bug or have any question, please let me know :
 
 * Twitter : @leo_gaspard
 * Mail : leo.gaspard@outlook.fr