Chenru Duan's repositories
OAReactDiff
An object-aware diffusion model for generating chemical reactions
MOFSimplify
The MOF website for property prediction and community engagement.
Language:C++000
molSimplify
molSimplify code
Language:PythonGPL-3.0000
MultirefPredict
Automated workflow to predict multireference character of molecules in quantum chemistry calculation
Language:PythonBSD-3-Clause000
Language:JavaScript000
qiskit-tutorials
A collection of Jupyter notebooks showing how to use the Qiskit SDK
Language:Jupyter NotebookApache-2.0000