ToBvalid version 0.9.8
=======================

ToBvalid is a Python library and a program for the statistical analysis and validation of ADPs (Atom displacement parameters).
It comes under MPL-2.0 license and supports Python3.


Dependencies
===================

pandas>=2.0.0
matplotlib>=3.0.0
numpy>=1.0.0
scipy>=1.0.0
gemmi>=0.6.0
seaborn>=0.13.0
statsmodels>=0.11.1
holoviews>=1.18.1
panel>=1.0.0

ToBvalid version 0.9.8 installation
====================================

For installation you may need administrator permissions, 
please consult your system administrator if needed.


Installing from source
--------------------------------------------
This is the recommended method of installation of ToBvalid. 
Type 'pip install tobvalid'


License
=======

ToBvalid-0.9.8 comes under Mozilla Public License Version 2.0 licence.


Citations
=========
Local and global analysis of macromolecular atomic displacement parameters
RC Masmaliyeva, KH Babai, GN Murshudov - Acta Crystallographica Section D: Structural Biology, 2020
https://doi.org/10.1107/S2059798320011043

Please contact authors: rmasmaliyeva@gmail.com,
lekaveh@gmail.com, garib@mrc-lmb.cam.ac.uk