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Shyue Ping Ong

Username    Shyue.Ping.Ong

18 projects

pymatgen

Last released

Python Materials Genomics is a robust materials analysis code that defines core object representations for structures

matgl

Last released

MatGL is a framework for graph deep learning for materials science.

monty

Last released

Monty is the missing complement to Python.

pymatgen-analysis-diffusion

Last released

Pymatgen add-on for diffusion analysis.

custodian

Last released

A simple JIT job management framework in Python.

maml

Last released

MAterials Machine Learning (maml) is a machine learning library for materials science.

matcalc

Last released

Calculators for materials properties from the potential energy surface.

usatt

Last released

Python tools for working with the USATT website.

pymatgen-db

Last released

Pymatgen-db is a database add-on for the Python Materials Genomics (pymatgen) materials analysis library.

mgnn

Last released

MGNN is a reimplementation of MatErials Graph Network (MEGNet) and Materials 3-body Graph Networks (M3GNet) in Deep Graph Library (DGL).

m3gnet

Last released

Materials Graph with Three-body Interactions

megnet

Last released

MatErials Graph Networks for machine learning of molecules and crystals.

flamyngo

Last released

Flamyngo is a customizable Flask frontend for MongoDB.

maml-apps-rfxas

Last released

maml-apps-rfxas is a maml add-on to perform RF analysis of X-ray Absorption Spectra.

zoter

Last released

Zoter is an interface to the Zotero API.

pyhull

Last released

A Python wrapper to Qhull (http://www.qhull.org/) for the computation of the convex hull, Delaunay triangulation and Voronoi diagram

gamma

Last released

gamma

symmetry

Last released

Symmetry is a library for materials symmetry analysis.

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