Items where Author is "Gasteiger, Johannes"

Article

Stocker, Sina and Gasteiger, Johannes and Becker, Florian and Günnemann, Stephan and Margraf, Johannes T (2022) How robust are modern graph neural network potentials in long and hot molecular dynamics simulations? Machine Learning: Science and Technology, 3 (4). 045010. ISSN 2632-2153