K. Alexander Heufer

Publication Activity (10 Years)

Years Active: 2020-2022
Publications (10 Years): 2

Top Topics

Rotationally Invariant

Top Venues

J. Chem. Inf. Model.

Publications

Jan G. Rittig, Martin Ritzert, Artur M. Schweidtmann, Stefanie Winkler, Jana M. Weber, Philipp Morsch, K. Alexander Heufer, Martin Grohe, Alexander Mitsos, Manuel Dahmen
Graph Machine Learning for Design of High-Octane Fuels. CoRR (2022)
Malte Döntgen, Yann Fenard, K. Alexander Heufer
Atomic Partial Charges as Descriptors for Barrier Heights. J. Chem. Inf. Model. 60 (12) (2020)