A Python library to crack crystals
Project description
Soprano is a Python library developed and maintained by the CCP for NMR Crystallography as a tool to help scientists working with crystallography and simulations to generate, manipulate, run calculations on and analyse large data sets of crystal structures, with a particular attention to the output of ab-initio random structure searching, or AIRSS. (https://www.mtg.msm.cam.ac.uk/Codes/AIRSS)
It provides a number of functionalities to help automate many common tasks in computational crystallography.
Release history Release notifications | RSS feed
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
Soprano-0.8.10.tar.gz
(139.4 kB
view hashes)
Built Distribution
Soprano-0.8.10-py3-none-any.whl
(203.8 kB
view hashes)
