QMLearn
DFTpy Developers
GitLab
References
Requirements
Installation from source
Tutorials
Creating a Database
Creating a QMModel: Fitting the Model and Predicting
Using a QMModel: Performing Geometry Optimization
Predicting chemical properties on a Jupyter Notebook!
Video Tutorials
qmlearn package
QMLearn
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Tutorials
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Predicting chemical properties on a Jupyter Notebook!
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Predicting chemical properties on a Jupyter Notebook!
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