Pevoskite conductivity predictor

This app is based on training of more than 500 perovskites stuctures with more than 9000 conductivity data points at different atmospheres and temperatures.

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Molecules solubility predictor

Gien the smiles strings of the molecule you want to predict and the solvent, the modle will predict the solubility at different temperatures.

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GPT-like conditional molecule generator

Provide conditions of the molecule properties you want to generate and press 'generate'. Two molecules will be generated accordingly with calculated properties.

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Smith_acidity_basicity

Smith scale of oxides acidity and basicity. Elements that have not been listed in the original paper are calculated based on deep learning results.

Smith_acidity_basicity