Felix Wodaczek
3 Publications
2025 | Published | Journal Article | IST-REx-ID: 18820 | 
Automatic feature selection and weighting in molecular systems using Differentiable Information Imbalance
R. Wild, F. Wodaczek, V. Del Tatto, B. Cheng, A. Laio, Nature Communications 16 (2025).
[Published Version]
View
| Files available
| DOI
| WoS
| PubMed | Europe PMC
R. Wild, F. Wodaczek, V. Del Tatto, B. Cheng, A. Laio, Nature Communications 16 (2025).
2023 | Published | Journal Article | IST-REx-ID: 13216 |
Reactivity of single-atom alloy nanoparticles: Modeling the dehydrogenation of propane
R. Bunting, F. Wodaczek, T. Torabi, B. Cheng, Journal of the American Chemical Society 145 (2023) 14894–14902.
[Published Version]
View
| Files available
| DOI
| WoS
| PubMed | Europe PMC
R. Bunting, F. Wodaczek, T. Torabi, B. Cheng, Journal of the American Chemical Society 145 (2023) 14894–14902.
2023 | Published | Journal Article | IST-REx-ID: 14425 |
Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations
Z. Zeng, F. Wodaczek, K. Liu, F. Stein, J. Hutter, J. Chen, B. Cheng, Nature Communications 14 (2023).
[Published Version]
View
| Files available
| DOI
| WoS
| PubMed | Europe PMC
| arXiv
Z. Zeng, F. Wodaczek, K. Liu, F. Stein, J. Hutter, J. Chen, B. Cheng, Nature Communications 14 (2023).
Search
Filter Publications
Display / Sort
Export / Embed
Grants
3 Publications
2025 | Published | Journal Article | IST-REx-ID: 18820 |
Automatic feature selection and weighting in molecular systems using Differentiable Information Imbalance
R. Wild, F. Wodaczek, V. Del Tatto, B. Cheng, A. Laio, Nature Communications 16 (2025).
[Published Version]
View
| Files available
| DOI
| WoS
| PubMed | Europe PMC
R. Wild, F. Wodaczek, V. Del Tatto, B. Cheng, A. Laio, Nature Communications 16 (2025).
2023 | Published | Journal Article | IST-REx-ID: 13216 |
Reactivity of single-atom alloy nanoparticles: Modeling the dehydrogenation of propane
R. Bunting, F. Wodaczek, T. Torabi, B. Cheng, Journal of the American Chemical Society 145 (2023) 14894–14902.
[Published Version]
View
| Files available
| DOI
| WoS
| PubMed | Europe PMC
R. Bunting, F. Wodaczek, T. Torabi, B. Cheng, Journal of the American Chemical Society 145 (2023) 14894–14902.
2023 | Published | Journal Article | IST-REx-ID: 14425 |
Mechanistic insight on water dissociation on pristine low-index TiO2 surfaces from machine learning molecular dynamics simulations
Z. Zeng, F. Wodaczek, K. Liu, F. Stein, J. Hutter, J. Chen, B. Cheng, Nature Communications 14 (2023).
[Published Version]
View
| Files available
| DOI
| WoS
| PubMed | Europe PMC
| arXiv
Z. Zeng, F. Wodaczek, K. Liu, F. Stein, J. Hutter, J. Chen, B. Cheng, Nature Communications 14 (2023).