Zobrazeno 1 - 10
of 10
pro vyhledávání: '"Hetzel, Leon"'
Publikováno v:
International Conference on Machine Learning. 2024. Oral
Although recent advances in higher-order Graph Neural Networks (GNNs) improve the theoretical expressiveness and molecular property predictive performance, they often fall short of the empirical performance of models that explicitly use fragment info
Externí odkaz:
http://arxiv.org/abs/2406.08210
Recent advances in machine learning for molecules exhibit great potential for facilitating drug discovery from in silico predictions. Most models for molecule generation rely on the decomposition of molecules into frequently occurring substructures (
Externí odkaz:
http://arxiv.org/abs/2305.19303
Machine learning for molecules holds great potential for efficiently exploring the vast chemical space and thus streamlining the drug discovery process by facilitating the design of new therapeutic molecules. Deep generative models have shown promisi
Externí odkaz:
http://arxiv.org/abs/2306.17246
Single-cell reference atlases are large-scale, cell-level maps that capture cellular heterogeneity within an organ using single cell genomics. Given their size and cellular diversity, these atlases serve as high-quality training data for the transfer
Externí odkaz:
http://arxiv.org/abs/2211.03793
Autor:
Hetzel, Leon, Böhm, Simon, Kilbertus, Niki, Günnemann, Stephan, Lotfollahi, Mohammad, Theis, Fabian
Single-cell transcriptomics enabled the study of cellular heterogeneity in response to perturbations at the resolution of individual cells. However, scaling high-throughput screens (HTSs) to measure cellular responses for many drugs remains a challen
Externí odkaz:
http://arxiv.org/abs/2204.13545
Autor:
Wagner, Jörg, Köhler, Jan Mathias, Gindele, Tobias, Hetzel, Leon, Wiedemer, Jakob Thaddäus, Behnke, Sven
To verify and validate networks, it is essential to gain insight into their decisions, limitations as well as possible shortcomings of training data. In this work, we propose a post-hoc, optimization based visual explanation method, which highlights
Externí odkaz:
http://arxiv.org/abs/1908.02686
Publikováno v:
Phys. Rev. A 96, 022323 (2017)
We consider the simulation of a quantum channel by two parties who share a resource state and may apply local operations assisted by classical communication (LOCC). One specific type of such LOCC is standard teleportation, which is however limited to
Externí odkaz:
http://arxiv.org/abs/1706.05384
Publikováno v:
In Current Opinion in Systems Biology December 2021 28
Autor:
Heumos, Lukas, Ehmele, Philipp, Treis, Tim, Upmeier zu Belzen, Julius, Roellin, Eljas, May, Lilly, Namsaraeva, Altana, Horlava, Nastassya, Shitov, Vladimir A., Zhang, Xinyue, Zappia, Luke, Knoll, Rainer, Lang, Niklas J., Hetzel, Leon, Virshup, Isaac, Sikkema, Lisa, Curion, Fabiola, Eils, Roland, Schiller, Herbert B., Hilgendorff, Anne, Theis, Fabian J.
Publikováno v:
Nature Medicine; November 2024, Vol. 30 Issue: 11 p3369-3380, 12p
Autor:
Lotfollahi, Mohammad, Klimovskaia Susmelj, Anna, De Donno, Carlo, Hetzel, Leon, Ji, Yuge, Ibarra, Ignacio L, Srivatsan, Sanjay R, Naghipourfar, Mohsen, Daza, Riza M, Martin, Beth, Shendure, Jay, McFaline‐Figueroa, Jose L, Boyeau, Pierre, Wolf, F Alexander, Yakubova, Nafissa, Günnemann, Stephan, Trapnell, Cole, Lopez‐Paz, David, Theis, Fabian J
Publikováno v:
Molecular Systems Biology; 6/12/2023, Vol. 19 Issue 6, p1-19, 19p