Dominik Lemm
0000-0002-8075-1765
Publication & Citation Trends
Publications
0 total
Impact of noise on inverse design: The case of NMR spectra matching OA
Cited by 6
Semantic Scholar
Ab initio machine learning of phase space averages. OA
Cited by 9
Semantic Scholar
Improved decision making with similarity based machine learning: applications in chemistry OA
Cited by 16
Semantic Scholar
PocketOptimizer 2.0: A modular framework for computer‐aided ligand‐binding design OA
Cited by 11
Semantic Scholar
SELFIES and the future of molecular string representations OA
Cited by 230
Semantic Scholar
Graph-To-Structure: Prediction of molecular structures, transition-states and solids from graphs
Cited by 0
Semantic Scholar
Machine learning based energy-free structure predictions of molecules, transition states, and solids OA
Cited by 83
Semantic Scholar
Coarse graining molecular dynamics with graph neural networks. OA
Cited by 201
Semantic Scholar
Research Topics
Machine Learning in Materials Science
(13)
Computational Drug Discovery Methods
(11)
Protein Structure and Dynamics
(8)
Ultrasonics and Acoustic Wave Propagation
(4)
Neural Networks and Applications
(3)
Affiliations
Institució Catalana de Recerca i Estudis Avançats
University of Vienna
Pompeu Fabra University
Max Planck Institute for Molecular Genetics
Center for Theoretical Biological Physics