The website for the Western Canadian Undergraduate Chemistry Conference (WCUCC) 2025.
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Jul 1, 2025 - Astro
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chemisty
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Pure TypeScript MMFF94 — energy, gradients, geometry optimization
typescript computational-chemistry force-field molecular-mechanics broswer merck molecular-modeling energy-minimization chemisty mmff94
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Aug 2, 2026 - TypeScript
An interactive periodic table of elements
data-visualization scientific-visualization chemical-elements periodic-table chemisty interactive-periodic-table
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Jul 27, 2026 - JavaScript
🚄 Training and applying large chemistry models for embeddings.
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Jun 13, 2025 - Python
MoleculeRankAI is an explainable AI platform for drug discovery that predicts and ranks promising molecular candidates using molecular fingerprints, graph neural networks, Random Forest, XGBoost, ensemble learning, and SHAP-based interpretability.
machine-learning deep-neural-networks deep-learning artificial-intelligence computational rdkit explainable-ai streamlit chemisty rdkit-chem
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Jul 21, 2026 - Jupyter Notebook
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