Matthias Rupp

1 papers · 2012–2012 · 1 venue · across top CS/AI venues

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Achievements

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🌉 Interdisciplinary Bridge · Silver 🐣 Hot Topic Early Bird 🌟 Keyword Trendsetter Combo (5) 🧭 Keyword Pioneer 📈 Trend Setter

Venues

NeurIPS (1)

Top co-authors

Andreas Ziehe (1) Katja Hansen (1) Grégoire Montavon (1) Franziska Biegler (1) Siamac Fazli (1) Klaus-Robert Müller (1) Anatole V. Lilienfeld (1) Alexandre Tkatchenko (1)

Research topics

Deep Learning (1) Healthcare & Medicine (1) Interdisciplinary (1) Machine Learning (1) Architectures (1) Bayesian & Probabilistic (1) Core Methods (1) Learning Types · Machine Learning (1) Learning Types · Deep Learning (1) Research (1) Science (1)

Keywords

graph representation (1) molecular machine learning (1) quantum mechanical energies (1) graph-like molecular data (1) atomization energy prediction (1) molecular geometry (1) atomization energy (1) graph-like data (1) molecular representation (1) invariant representation (1) molecular property prediction (1) molecular representation learning (1) graph neural network (1) quantum-mechanical energy (1) chemical accuracy (1)

Papers

Learning Invariant Representations of Molecules for Atomization Energy Prediction NeurIPS 2012