Mechanism by which DHA inhibits the aggregation of KLVFFA peptides: A molecular dynamics study
- Hong Zhou
- Shengtang Liu
- et al.
- 2018
- Journal of Chemical Physics
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Propensity of a single-walled carbon nanotube-peptide to mimic a KK10 peptide in an HLA-TCR complex
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Double photoionization of tropone and cyclooctatetraene
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- Journal of Chemical Physics
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- Journal of Chemical Physics
Nonadiabatic dynamics with intersystem crossings: A time-dependent density functional theory implementation
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- Journal of Chemical Physics
Simplified TiO2 force fields for studies of its interaction with biomolecules
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- Journal of Chemical Physics
The ground state and electronic structure of Gd@C82: A systematic theoretical investigation of first principle density functional
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