Johannes C. B. Dietschreit

According to our database, Johannes C. B. Dietschreit authored at least 4 papers between 2023 and 2024.

Collaborative distances:

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

2024

Enhanced sampling of robust molecular datasets with uncertainty-based collective variables.

Aik Rui Tan, Johannes C. B. Dietschreit, Rafael Gómez-Bombarelli

CoRR, 2024

Learning Collective Variables for Protein Folding with Labeled Data Augmentation through Geodesic Interpolation.

Soojung Yang, Juno Nam, Johannes C. B. Dietschreit, Rafael Gómez-Bombarelli

CoRR, 2024

2023

Single-model uncertainty quantification in neural network potentials does not consistently outperform model ensembles.

Aik Rui Tan, Shingo Urata, Samuel Goldman, Johannes C. B. Dietschreit, Rafael Gómez-Bombarelli

CoRR, 2023

Differentiable Simulations for Enhanced Sampling of Rare Events.

Martin Sípka, Johannes C. B. Dietschreit, Lukás Grajciar, Rafael Gómez-Bombarelli

Proceedings of the International Conference on Machine Learning, 2023