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Ying Yuan
ORCID
Publication Activity (10 Years)
Years Active: 2018-2023
Publications (10 Years): 7
Top Topics
Raman Spectroscopy
Carbon Dioxide
Preterm Infants
Density Functional Theory
Top Venues
The Journal of chemical physics
The journal of physical chemistry. B
The journal of physical chemistry. A
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This page only lists publications with an associated author ORCID identifier.
Publications
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Ying Yuan
,
Feng Wang
Dipole Cooperativity and Polarization Frustration Determine the Secondary Structure Distribution of Short Alanine Peptides in Water.
The journal of physical chemistry. B
(2023)
Dong Zheng
,
Ying Yuan
,
Feng Wang
Fragmentation Method for Computing Quantum Mechanics and Molecular Mechanics Gradients for Force Matching: Validation with Hydration Free Energy Predictions Using Adaptive Force Matching.
The journal of physical chemistry. A
126 (16) (2022)
Ying Yuan
,
Zhonghua Ma
,
Feng Wang
Development and Validation of a DFT-Based Force Field for a Hydrated Homoalanine Polypeptide.
The journal of physical chemistry. B
125 (6) (2021)
Dong Zheng
,
Ying Yuan
,
Feng Wang
Determining the hydration free energies of selected small molecules with MP2 and local MP2 through adaptive force matching.
The Journal of chemical physics
154 (10) (2021)
Ying Yuan
,
Feng Wang
A comparison of three DFT exchange-correlation functionals and two basis sets for the prediction of the conformation distribution of hydrated polyglycine.
The Journal of chemical physics
155 (9) (2021)
Ying Yuan
,
Zhonghua Ma
,
Feng Wang
Leveraging local MP2 to reduce basis set superposition errors: An efficient first-principles based force-field for carbon dioxide.
The Journal of chemical physics
151 (18) (2019)
Ying Yuan
,
Jicun Li
,
Xin-Zheng Li
,
Feng Wang
The strengths and limitations of effective centroid force models explored by studying isotopic effects in liquid water.
The Journal of chemical physics
148 (18) (2018)