Po-Jen Hsu

15PUBLICATIONS
16CO-AUTHORS
Nonlinear optics and spectroscopyChemical thermodynamics and energeticsBiomolecular modelling and designTheoretical quantum chemistryComputational chemistry
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Publications (15)

|Nov 18, 2025
A Deep-Learning Neural Network Potential Accelerated First-Principles Study on the Structural Changes Modulated by Methylation and Solvation in 27 Protonated Tripeptides.

Dong Cao Hieu, Po-Jen Hsu, Jer-Lai Kuo

|Aug 15, 2025
Linear-cyclic isomer competition in protonated ethanol-methanol clusters probed by infrared spectroscopy and deep-learning structural and dynamical simulations.

Po-Jen Hsu, Atsuya Mizuide, Jer-Lai Kuo

|May 22, 2025
Unraveling the low-energy conformers of neutral and charged mono- and di-saccharides with first-principles accuracy assisted by neural network potentials.

Huu Trong Phan, Pei-Kang Tsou, Hieu Cao Dong

|Oct 29, 2024
Hydrogen bond network structures of protonated 2,2,2-trifluoroethanol/ethanol mixed clusters probed by infrared spectroscopy combined with a deep-learning structure sampling approach: the origin of the linear type network preference in protonated fluoroalcohol clusters.

Po-Jen Hsu, Atsuya Mizuide, Jer-Lai Kuo

|Mar 26, 2024
Searching low-energy conformers of neutral and protonated di-, tri-, and tetra-glycine using first-principles accuracy assisted by the use of neural network potentials.

Hieu Cao Dong, Po-Jen Hsu, Jer-Lai Kuo

|Mar 08, 2024
A first-principles exploration of the conformational space of sodiated di-saccharides assisted by semi-empirical methods and neural network potentials.

Huu Trong Phan, Pei-Kang Tsou, Po-Jen Hsu

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Frequent Collaborators

14 joint publications

Jer-Lai Kuo

4 joint publications

Asuka Fujii

4 joint publications

Pei-Kang Tsou

2 joint publications

Yuan-Pern Lee