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AlishbaImran
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Update app.py
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app.py
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Using an attention-based graph convolutional neural network technique, I've developed a model that can take in reactants as SMILEs and predict the reaction energy in the redox reaction.
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A lot of this work was inspired and built on top of
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''')
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Using an attention-based graph convolutional neural network technique, I've developed a model that can take in reactants as SMILEs and predict the reaction energy in the redox reaction.
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A lot of this work was inspired and built on top of this [paper](https://chemrxiv.org/engage/chemrxiv/article-details/60c7575f469df44a40f45465) and this [platform](https://github.com/mcsorkun/RedPred-web). Feel free to give it a try and reach out for any feedback. Email: alishbai734@gmail.com.
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''')
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