Yousung Jung's group repo (kaist-amsg)

Yousung Jung's group repo

kaist-amsg

Geek Repo

Home Page:http://qchem.kaist.ac.kr/

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Yousung Jung's group repo's repositories

LocalRetro

Retrosynthesis prediction for organic molecules with LocalRetro

Language:PythonLicense:Apache-2.0Stargazers:79Issues:7Issues:18

Composition-Conditioned-Crystal-GAN

Composition-Conditioned Crystal GAN pytorch code

imatgen

image-based generative model for inverse design of solid state materials

LocalTransform

Predicting Organic Reactivity with LocalTransform

Language:Jupyter NotebookLicense:Apache-2.0Stargazers:34Issues:2Issues:4
Language:PythonStargazers:9Issues:3Issues:0

ElemwiseRetro

Predicting Synthesis Recipes of Inorganic Crystal Materials using Elementwise Template Formulation

Language:PythonStargazers:6Issues:2Issues:0

LS-CGCNN-ens

Labeled site representation and ensemble method for binding energy prediction

Language:Jupyter NotebookStargazers:2Issues:3Issues:0
Language:PythonStargazers:0Issues:0Issues:0