Enhanced diffusion sampling: Efficient rare event sampling and free energy calculation with diffusion models.

Xie Y, Winkler L, Sun L, Lewis S, Foster AE, Jiménez Luna J, Hempel T, Gastegger M, Chen Y, Zaporozhets I, Clementi C, Bishop CM, Noé F

Open source

DOI
10.1063/5.0350170
Published
2026 Oct 28
Container
The Journal of chemical physics
Publisher
Not recorded
Open access
unknown

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BibTeX

@article{allodium:10.1063/5.0350170,
  title = {Enhanced diffusion sampling: Efficient rare event sampling and free energy calculation with diffusion models.},
  author = {Xie Y and Winkler L and Sun L and Lewis S and Foster AE and Jiménez Luna J and Hempel T and Gastegger M and Chen Y and Zaporozhets I and Clementi C and Bishop CM and Noé F},
  year = {2026},
  journal = {The Journal of chemical physics},
  doi = {10.1063/5.0350170},
  url = {https://doi.org/10.1063/5.0350170}
}

RIS

TY  - JOUR
TI  - Enhanced diffusion sampling: Efficient rare event sampling and free energy calculation with diffusion models.
AU  - Xie Y
AU  - Winkler L
AU  - Sun L
AU  - Lewis S
AU  - Foster AE
AU  - Jiménez Luna J
AU  - Hempel T
AU  - Gastegger M
AU  - Chen Y
AU  - Zaporozhets I
AU  - Clementi C
AU  - Bishop CM
AU  - Noé F
PY  - 2026
JO  - The Journal of chemical physics
DO  - 10.1063/5.0350170
UR  - https://doi.org/10.1063/5.0350170
ER  - 

APA

Y, X., L, W., L, S., S, L., AE, F., J, J. L., T, H., M, G., Y, C., I, Z., C, C., CM, B., & F, N. (2026). Enhanced diffusion sampling: Efficient rare event sampling and free energy calculation with diffusion models.. The Journal of chemical physics. https://doi.org/10.1063/5.0350170

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