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pro vyhledávání: '"PROTEIN DYNAMICS"'
Modeling and simulating the protein folding process overall remains a grand challenge in computational biology. We systematically investigate end-to-end quantum algorithms for simulating various protein dynamics with effects, such as mechanical force
Externí odkaz:
http://arxiv.org/abs/2411.03972
Autor:
Costa, Allan dos Santos, Mitnikov, Ilan, Pellegrini, Franco, Daigavane, Ameya, Geiger, Mario, Cao, Zhonglin, Kreis, Karsten, Smidt, Tess, Kucukbenli, Emine, Jacobson, Joseph
Mapping the conformational dynamics of proteins is crucial for elucidating their functional mechanisms. While Molecular Dynamics (MD) simulation enables detailed time evolution of protein motion, its computational toll hinders its use in practice. To
Externí odkaz:
http://arxiv.org/abs/2410.09667
Autor:
MacIver, Alec, Shaheen, Hina
Alzheimer's disease (AD) is a complex neurodegenerative disorder characterized by the progressive accumulation of misfolded proteins, leading to cognitive decline. This study presents a novel stochastic modelling approach to simulate the propagation
Externí odkaz:
http://arxiv.org/abs/2411.02644
Autor:
Son, Ahrum1 (AUTHOR) ahson@scripps.edu, Kim, Woojin2 (AUTHOR) woojin1544@gmail.com, Park, Jongham2 (AUTHOR) 975pjh@gmail.com, Lee, Wonseok2 (AUTHOR) wonseogi46@gmail.com, Lee, Yerim2 (AUTHOR) leeyarim53@gmail.com, Choi, Seongyun3 (AUTHOR) akfhd1212@gmail.com, Kim, Hyunsoo2,3,4,5 (AUTHOR) kimlab@cnu.ac.kr
Publikováno v:
International Journal of Molecular Sciences. Sep2024, Vol. 25 Issue 17, p9725. 28p.
Akademický článek
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Autor:
Zhao, Yan1 (AUTHOR) zhaoyan@hhrrc.ac.cn, Wang, Yanru2 (AUTHOR)
Publikováno v:
International Journal of Molecular Sciences. Dec2024, Vol. 25 Issue 23, p12951. 15p.