Publications per year
Publications per year
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Dive into the research topics where Bjarke Arnskjær Hastrup is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
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OM-Diff: inverse-design of organometallic catalysts with guided equivariant denoising diffusion
Cornet, F., Benediktsson, B., Hastrup, B., Schmidt, M. N. & Bhowmik, A., 2024, In: Digital Discovery. 3, 9, p. 1793-1811 19 p.Research output: Contribution to journal › Journal article › Research › peer-review
Open AccessFile12 Downloads (Pure) -
Inverse-design of organometallic catalysts with guided equivariant diffusion
Cornet, F. R. J., Benediktsson, B., Hastrup, B. A., Bhowmik, A. & Schmidt, M. N., 2023, Proceedings of 37th Conference on Neural Information Processing Systems. 9 p.Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research › peer-review
Open AccessFile128 Downloads (Pure)
Projects
- 1 Active
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Machine Learning Models for All-Atom, Long Time-Scale Simulations of Enzymatic Catalysts
Hastrup, B. A. (PhD Student), Vegge, T. (Main Supervisor) & Bhowmik, A. (Supervisor)
01/10/2021 → 31/05/2025
Project: PhD