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Aik Rui Tan

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2020 – today

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2024
[i3]
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  - journals/corr/abs-2402-03753
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  - https://dblp.org/rec/journals/corr/abs-2402-03753
Aik Rui Tan, Johannes C. B. Dietschreit, Rafael Gómez-Bombarelli:
Enhanced sampling of robust molecular datasets with uncertainty-based collective variables. CoRR abs/2402.03753 (2024)
2023
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  - journals/corr/abs-2305-01754
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Aik Rui Tan, Shingo Urata, Samuel Goldman, Johannes C. B. Dietschreit, Rafael Gómez-Bombarelli:
Single-model uncertainty quantification in neural network potentials does not consistently outperform model ensembles. CoRR abs/2305.01754 (2023)
2021
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  - journals/corr/abs-2101-11588
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Daniel Schwalbe-Koda, Aik Rui Tan, Rafael Gómez-Bombarelli:
Adversarial Attacks on Uncertainty Enable Active Learning for Neural Network Potentials. CoRR abs/2101.11588 (2021)

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