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README.md
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---
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language: en
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tags:
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- glass
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- materials-science
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- inorganic-chemistry
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- regression
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- scikit-learn
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- xgboost
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- property-prediction
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license: mit
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datasets:
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- epam/SciGlass
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---
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# Vitreos 🔬
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**Glass property prediction from oxide composition using machine learning.**
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Developed by [Doruk Doğular](https://github.com/dorukdogular) · [GitHub](https://github.com/dorukdogular/vitreos) · [Live Demo](https://vitreos.streamlit.app)
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## Models
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| Property | Samples | R² | MAE |
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|---|---|---|---|
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| Tg | 76,377 | 0.85 | 44 K |
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| Density | 31,173 | 0.88 | 0.26 g/cm³ |
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| Refractive Index | 58,913 | 0.83 | 0.036 |
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| GFA | 11,858 | — | 69% acc |
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## Usage
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```python
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import joblib, json, numpy as np
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model = joblib.load("tg_regressor.pkl")
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with open("tg_features.json") as f:
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features = json.load(f)
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comp = {f: 0.0 for f in features}
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comp["SiO2"] = 72.0
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comp["Na2O"] = 14.0
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comp["CaO"] = 9.0
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X = np.array([[comp[f] for f in features]])
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print(f"Tg: {model.predict(X)[0]:.1f} K")
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```
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## Dataset
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Trained on [SciGlass](https://github.com/epam/SciGlass) by EPAM Systems — 422,000+ inorganic glass compositions, ODbL license.
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## Author
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**Doruk Doğular** · [@dorukdogular](https://github.com/dorukdogular)
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## License
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MIT (model) · ODbL (dataset)
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