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Aik Rui Tan

2PUBLICATIONS

3CO-AUTHORS

Statistical mechanics in chemistryTheoretical quantum chemistry

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Publications (2)

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|Jan 15, 2025

Enhanced sampling of robust molecular datasets with uncertainty-based collective variables.

Aik Rui Tan, Johannes C B Dietschreit, Rafael Gómez-Bombarelli

|Aug 25, 2021

Differentiable sampling of molecular geometries with uncertainty-based adversarial attacks.

Daniel Schwalbe-Koda, Aik Rui Tan, Rafael Gómez-Bombarelli

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Frequent Collaborators

2 joint publications

Rafael Gómez-Bombarelli

1 joint publications

Daniel Schwalbe-Koda

1 joint publications

Johannes C B Dietschreit

Frequent Collaborators

2 joint publications

Rafael Gómez-Bombarelli

1 joint publications

Daniel Schwalbe-Koda

1 joint publications

Johannes C B Dietschreit

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