Yunwen Tao

Publication Activity (10 Years)

Years Active: 2018-2021
Publications (10 Years): 4

Top Topics

Comparative Evaluation

Binding Peptides

Correlation Analysis

Similarity Metric

Top Venues

J. Comput. Chem.

Publications

Sadisha Nanayakkara, Yunwen Tao, Elfi Kraka
Comment on "Exploring nature and predicting strength of hydrogen bonds: A correlation analysis between atoms-in-molecules descriptors, binding energies, and energy components of symmetry-adapted perturbation theory". J. Comput. Chem. 42 (7) (2021)
Niraj Verma, Yunwen Tao, Wenli Zou, Xia Chen, Xin Chen, Marek Freindorf, Elfi Kraka
A Critical Evaluation of Vibrational Stark Effect (VSE) Probes with the Local Vibrational Mode Theory. Sensors 20 (8) (2020)
Yunwen Tao, Linyao Zhang, Wenli Zou, Elfi Kraka
Equilibrium Geometries, Adiabatic Excitation Energies and Intrinsic C=C/C-H Bond Strengths of Ethylene in Lowest Singlet Excited States Described by TDDFT. Symmetry 12 (9) (2020)
Yunwen Tao, Wenli Zou, Dieter Cremer, Elfi Kraka
Correlating the vibrational spectra of structurally related molecules: A spectroscopic measure of similarity. J. Comput. Chem. 39 (6) (2018)