E-LIB Suche - Ergebnisse für: Tan, Aik Rui

1

Modifying ring structures in lithium borate glasses under c..:

Urata, Shingo ; Tan, Aik Rui ; Gómez-Bombarelli, Rafael
Physical Review Materials. 8 (2024) 3 - p. , 2024

Link: https://doi.org/10.1103/..

2

Single-model uncertainty quantification in neural network p..:

Tan, Aik Rui ; Urata, Shingo ; Goldman, Samuel..
npj Computational Materials. 9 (2023) 1 - p. , 2023

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

3

Representations of Materials for Machine Learning:

Damewood, James ; Karaguesian, Jessica ; Lunger, Jaclyn R....
Annual Review of Materials Research. 53 (2023) 1 - p. 399-426 , 2023

Link: https://doi.org/10.1146/..

4

Graph theory-based structural analysis on density anomaly o..:

Tan, Aik Rui ; Urata, Shingo ; Yamada, Masatsugu.
Computational Materials Science. 225 (2023) - p. 112190 , 2023

Link: https://doi.org/10.1016/..

5

Suppression of Rayleigh Scattering in Silica Glass by Codop..:

Urata, Shingo ; Nakamura, Nobuhiro ; Tada, Tomofumi...
The Journal of Physical Chemistry C. 126 (2022) 4 - p. 2264-2275 , 2022

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

6

Differentiable sampling of molecular geometries with uncert..:

Schwalbe-Koda, Daniel ; Tan, Aik Rui ; Gómez-Bombarelli, Rafael
Nature Communications. 12 (2021) 1 - p. , 2021

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

7

Collective variable discovery and enhanced sampling using a..:

Chen, Wei ; Tan, Aik Rui ; Ferguson, Andrew L.
The Journal of Chemical Physics. 149 (2018) 7 - p. , 2018

Link: https://doi.org/10.1063/..

8

Representations of Materials for Machine Learning:

Damewood, James ; Karaguesian, Jessica ; Lunger, Jaclyn R...
http://arxiv.org/abs/2301.08813. , 2023

Link: http://arxiv.org/abs/230..

9

Single-model uncertainty quantification in neural network p..:

Tan, Aik Rui ; Urata, Shingo ; Goldman, Samuel..
http://arxiv.org/abs/2305.01754. , 2023

Link: http://arxiv.org/abs/230..

10

Differentiable sampling of molecular geometries with uncert..:

Schwalbe-Koda, Daniel ; Tan, Aik Rui ; Gómez-Bombarelli, Rafael
10.1038/S41467-021-25342-8. , 2022

Link: https://hdl.handle.net/1..

11

Graph theory-based structural analysis on density anomaly o..:

Tan, Aik Rui ; Urata, Shingo ; Yamada, Masatsugu.
http://arxiv.org/abs/2111.07452. , 2021

Link: http://arxiv.org/abs/211..

12

Differentiable sampling of molecular geometries with uncert..:

Schwalbe-Koda, Daniel ; Tan, Aik Rui ; Gómez-Bombarelli, Rafael
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC8384857/. , 2021

Link: http://www.ncbi.nlm.nih...

13

Differentiable sampling of molecular geometries with uncert..:

Schwalbe-Koda, Daniel ; Tan, Aik Rui ; Gómez-Bombarelli, Rafael
http://arxiv.org/abs/2101.11588. , 2021

Link: http://arxiv.org/abs/210..

14

Single-model uncertainty quantification in neural network p..:

Aik Rui Tan ; Shingo Urata ; Samuel Goldman..
https://doi.org/10.1038/s41524-023-01180-8. , 2023

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

15

Differentiable sampling of molecular geometries with uncert..:

Daniel Schwalbe-Koda ; Aik Rui Tan ; Rafael Gómez-Bombarelli
https://doi.org/10.1038/s41467-021-25342-8. , 2021

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