3 Publications

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[3]
2025 | Published | Journal Article | IST-REx-ID: 18820 | OA
R. Wild, F. Wodaczek, V. Del Tatto, B. Cheng, and A. Laio, “Automatic feature selection and weighting in molecular systems using Differentiable Information Imbalance,” Nature Communications, vol. 16. Springer Nature, 2025.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC
 
[2]
2023 | Published | Journal Article | IST-REx-ID: 13216 | OA
R. Bunting, F. Wodaczek, T. Torabi, and B. Cheng, “Reactivity of single-atom alloy nanoparticles: Modeling the dehydrogenation of propane,” Journal of the American Chemical Society, vol. 145, no. 27. American Chemical Society, pp. 14894–14902, 2023.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC
 
[1]
2023 | Published | Journal Article | IST-REx-ID: 14425 | OA
Z. Zeng et al., “Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations,” Nature Communications, vol. 14. Springer Nature, 2023.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC | arXiv
 

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3 Publications

Mark all

[3]
2025 | Published | Journal Article | IST-REx-ID: 18820 | OA
R. Wild, F. Wodaczek, V. Del Tatto, B. Cheng, and A. Laio, “Automatic feature selection and weighting in molecular systems using Differentiable Information Imbalance,” Nature Communications, vol. 16. Springer Nature, 2025.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC
 
[2]
2023 | Published | Journal Article | IST-REx-ID: 13216 | OA
R. Bunting, F. Wodaczek, T. Torabi, and B. Cheng, “Reactivity of single-atom alloy nanoparticles: Modeling the dehydrogenation of propane,” Journal of the American Chemical Society, vol. 145, no. 27. American Chemical Society, pp. 14894–14902, 2023.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC
 
[1]
2023 | Published | Journal Article | IST-REx-ID: 14425 | OA
Z. Zeng et al., “Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations,” Nature Communications, vol. 14. Springer Nature, 2023.
[Published Version] View | Files available | DOI | WoS | PubMed | Europe PMC | arXiv
 

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Citation Style: IEEE

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