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Stefan Gugler

Showing results (1-10 of 4) with videos related to

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Journal of Chemical Theory and Computation|October 11, 2022
Quantum Chemical Roots of Machine-Learning Molecular Similarity DescriptorsStefan Gugler, Markus Reiher
Journal of Chemical Theory and Computation|October 12, 2019
Gaussian Process-Based Refinement of Dispersion CorrectionsJonny Proppe, Stefan Gugler, Markus Reiher
The Journal of Chemical Physics|March 3, 2026
How simple can you go? An off-the-shelf transformer approach to molecular dynamicsMax Eissler, Tim Korjakow, Stefan Ganscha, et al.
The Journal of Chemical Physics|November 15, 2022
Ligand additivity relationships enable efficient exploration of transition metal chemical spaceNaveen Arunachalam, Stefan Gugler, Michael G Taylor, et al.
Pageof 1

Showing results (1-10 of 4) with videos related to

Sort By:
Pageof 1
Journal of Chemical Theory and Computation|October 11, 2022
Quantum Chemical Roots of Machine-Learning Molecular Similarity DescriptorsStefan Gugler, Markus Reiher
Journal of Chemical Theory and Computation|October 12, 2019
Gaussian Process-Based Refinement of Dispersion CorrectionsJonny Proppe, Stefan Gugler, Markus Reiher
The Journal of Chemical Physics|March 3, 2026
How simple can you go? An off-the-shelf transformer approach to molecular dynamicsMax Eissler, Tim Korjakow, Stefan Ganscha, et al.
The Journal of Chemical Physics|November 15, 2022
Ligand additivity relationships enable efficient exploration of transition metal chemical spaceNaveen Arunachalam, Stefan Gugler, Michael G Taylor, et al.
Pageof 1