Metadata-Version: 2.1
Name: AtomicAI
Version: 0.2.1
Summary: Processing and visualization of atomic coordinates 
Home-page: https://github.com/SelvaGith/AtomicAI
Author: Selva Chandrasekaran
Author-email: selvachandrasekar.s@gmail.com
License: MIT
Project-URL: Bug Tracker, https://github.com/SelvaGith/AtomicAI/issues
Classifier: Intended Audience :: Science/Research
Classifier: Programming Language :: Python :: 3.9
Classifier: License :: OSI Approved :: GNU General Public License v3 (GPLv3)
Requires-Python: >=3.9
Description-Content-Type: text/markdown
License-File: LICENSE.md
Requires-Dist: pip (>=22.1.2)
Requires-Dist: wheel (>=0.37.1)

# AtomicAI
## Analysis
Processing and visualization of atomic coordinates of different file formats such as CIF, VASP, XYZ, Conquest, etc.
AtomicAI uses 'ase' code for reading and writing structure files.

## Data processing
Classification of atoms in a trajectory file.

## Machine learning
Featurization of atomic structures and Reduction feature dimensions

## Clustering and visualization of data
Use various clustering methods and plot the data
