Stefan N. Heinen

According to our database, Stefan N. Heinen authored at least 5 papers between 2016 and 2024.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2024

Autonomous data extraction from peer reviewed literature for training machine learning models of oxidation potentials.

Siwoo Lee, Stefan N. Heinen, Danish Khan, O. Anatole von Lilienfeld

Mach. Learn. Sci. Technol., 2024

Reducing training data needs with minimal multilevel machine learning (M3L).

Stefan N. Heinen, Danish Khan, Guido Falk von Rudorff, Konstantin Karandashev, Daniel J. Arismendi-Arrieta, Alastair J. A. Price, Surajit Nandi, Arghya Bhowmik, Kersti Hermansson, O. Anatole von Lilienfeld

Mach. Learn. Sci. Technol., 2024

2020

Thousands of reactants and transition states for competing E2 and S$_\mathrm{N}$2 reactions.

Guido Falk von Rudorff, Stefan N. Heinen, Marco Bragato, O. Anatole von Lilienfeld

Mach. Learn. Sci. Technol., 2020

Machine learning the computational cost of quantum chemistry.

Stefan N. Heinen, Max Schwilk, Guido Falk von Rudorff, O. Anatole von Lilienfeld

Mach. Learn. Sci. Technol., 2020

2016

The quantum chemical search for novel materials and the issue of data processing: The InfoMol project.

Hans Peter Lüthi, Stefan N. Heinen, Gisbert Schneider, Andreas Glöss, Martin P. Brändle, Rollin A. King, Edward Pyzer-Knapp, Fahhad H. Alharbi, Sabre Kais

J. Comput. Sci., 2016