Scientific Software
Updated 6 months ago
FlowerMD
FlowerMD: Flexible Library of Organic Workflows and Extensible Recipes for Molecular Dynamics - Published in JOSS (2023)
Scientific Software · Peer-reviewed
Updated 6 months ago
https://github.com/radonpy/radonpy
RadonPy is a Python library to automate physical property calculations for polymer informatics.
Updated 6 months ago
https://github.com/usnistgov/pyprism
A framework for conducting polymer reference interaction site model (PRISM) calculations
Updated 6 months ago
pylimer-tools
A collection of utility python functions for handling bead-spring polymer networks and LAMMPS output in Python
Sociology
Artificial Intelligence and Machine Learning
Updated 6 months ago
simulation-two-chain-paa
Simulate interactions between two fully-charged PAA chains with varying amounts of CaCl2 added