E-LIB Suche - Ergebnisse für: Clyde, Austin

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Transferable Graph Neural Fingerprint Models for Quick Resp..:

, In: 2023 International Conference on Machine Learning and Applications (ICMLA),

Chen, Wei ; Ren, Yihui ; Kagawa, Ai... - p. 800-807 , 2023

Link: https://doi.org/10.1109/..

2

ChemoGraph: Interactive Visual Exploration of the Chemical ..:

Kale, Bharat ; Clyde, Austin ; Sun, Maoyuan...
Computer Graphics Forum. 42 (2023) 3 - p. 13-24 , 2023

Link: https://doi.org/10.1111/..

3

Deep learning methods for drug response prediction in cance..:

Partin, Alexander ; Brettin, Thomas S. ; Zhu, Yitan...
Frontiers in Medicine. 10 (2023) - p. , 2023

Link: https://doi.org/10.3389/..

4

AI-Accelerated Design of Targeted Covalent Inhibitors for S..:

Joshi, Rajendra P. ; Schultz, Katherine J. ; Wilson, Jesse William...
Journal of Chemical Information and Modeling. 63 (2023) 5 - p. 1438-1453 , 2023

Link: https://doi.org/10.1021/..

5

GenSLMs: Genome-scale language models reveal SARS-CoV-2 evo..:

Zvyagin, Maxim ; Brace, Alexander ; Hippe, Kyle...
The International Journal of High Performance Computing Applications. 37 (2023) 6 - p. 683-705 , 2023

Link: https://doi.org/10.1177/..

6

AI-accelerated protein-ligand docking for SARS-CoV-2 is 100..:

Clyde, Austin ; Liu, Xuefeng ; Brettin, Thomas...
Scientific Reports. 13 (2023) 1 - p. , 2023

Link: https://doi.org/10.1038/..

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Integration of Computational Docking into Anti-Cancer Drug ..:

Narykov, Oleksandr ; Zhu, Yitan ; Brettin, Thomas...
Cancers. 16 (2023) 1 - p. 50 , 2023

Link: https://doi.org/10.3390/..

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Intelligent resolution: Integrating Cryo-EM with AI-driven ..:

Trifan, Anda ; Gorgun, Defne ; Salim, Michael...
The International Journal of High Performance Computing Applications. 36 (2022) 5-6 - p. 603-623 , 2022

Link: https://doi.org/10.1177/..

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#COVIDisAirborne: AI-enabled multiscale computational micro..:

Dommer, Abigail ; Casalino, Lorenzo ; Kearns, Fiona...
The International Journal of High Performance Computing Applications. 37 (2022) 1 - p. 28-44 , 2022

Link: https://doi.org/10.1177/..

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