coudertlab Goto Github PK
Name: Coudert lab
Type: Organization
Blog: http://coudert.name
Coudert lab's Projects
amof
A python package to analyze Molecular Dynamics (MD) trajectories of amorphous Metal-Organic Frameworks (MOFs).
core-mof
CoRE-MOF as a Python package
crystalnets.jl
A julia package for the manipulation of crystal net representations and topology
elate
ELATE: Elastic tensor analysis
faeb
Fast Energy Barrier (FaEB) evaluation tool to assess diffusion in nanoporous materials
graed
Grid Adsorption Energy Descriptors
raess
Rapid Adsorption Enthalpy Surface Sampling
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