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Nature Communications
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July 11, 2023
Author Correction: Efficient interatomic descriptors for accurate machine learning force fields of extended molecules
Adil Kabylda, Valentin Vassilev-Galindo, Stefan Chmiela, et al.
Nature Communications
|
June 15, 2023
Efficient interatomic descriptors for accurate machine learning force fields of extended molecules
Adil Kabylda, Valentin Vassilev-Galindo, Stefan Chmiela, et al.
Journal of Chemical Theory and Computation
|
January 10, 2025
Analyzing Atomic Interactions in Molecules as Learned by Neural Networks
Malte Esders, Thomas Schnake, Jonas Lederer, et al.
Science Advances
|
January 11, 2023
Accurate global machine learning force fields for molecules with hundreds of atoms
Stefan Chmiela, Valentin Vassilev-Galindo, Oliver T Unke, et al.
Journal of the American Chemical Society
|
August 31, 2025
Molecular Simulations with a Pretrained Neural Network and Universal Pairwise Force Fields
Adil Kabylda, J Thorben Frank, Sergio Suárez-Dou, et al.
Chemical Science
|
February 6, 2025
Crash testing machine learning force fields for molecules, materials, and interfaces: molecular dynamics in the TEA challenge 2023
Igor Poltavsky, Mirela Puleva, Anton Charkin-Gorbulin, et al.
Chemical Science
|
February 12, 2025
Crash testing machine learning force fields for molecules, materials, and interfaces: model analysis in the TEA Challenge 2023
Igor Poltavsky, Anton Charkin-Gorbulin, Mirela Puleva, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
Nature Communications
|
July 11, 2023
Author Correction: Efficient interatomic descriptors for accurate machine learning force fields of extended molecules
Adil Kabylda, Valentin Vassilev-Galindo, Stefan Chmiela, et al.
Nature Communications
|
June 15, 2023
Efficient interatomic descriptors for accurate machine learning force fields of extended molecules
Adil Kabylda, Valentin Vassilev-Galindo, Stefan Chmiela, et al.
Journal of Chemical Theory and Computation
|
January 10, 2025
Analyzing Atomic Interactions in Molecules as Learned by Neural Networks
Malte Esders, Thomas Schnake, Jonas Lederer, et al.
Science Advances
|
January 11, 2023
Accurate global machine learning force fields for molecules with hundreds of atoms
Stefan Chmiela, Valentin Vassilev-Galindo, Oliver T Unke, et al.
Journal of the American Chemical Society
|
August 31, 2025
Molecular Simulations with a Pretrained Neural Network and Universal Pairwise Force Fields
Adil Kabylda, J Thorben Frank, Sergio Suárez-Dou, et al.
Chemical Science
|
February 6, 2025
Crash testing machine learning force fields for molecules, materials, and interfaces: molecular dynamics in the TEA challenge 2023
Igor Poltavsky, Mirela Puleva, Anton Charkin-Gorbulin, et al.
Chemical Science
|
February 12, 2025
Crash testing machine learning force fields for molecules, materials, and interfaces: model analysis in the TEA Challenge 2023
Igor Poltavsky, Anton Charkin-Gorbulin, Mirela Puleva, et al.
Page
of 1