| 1 |
Phosphorothioate Substitutions in RNA Structure Studied by Molecular Dynamics Simulations, QM/MM Calculations, and NMR Experiments
Zhang ZY, Vogele J, Mrazikova K, Kruse H, Cang XH, Wohnert J, Krepl M, Sponer J
Journal of Physical Chemistry B, 125(3), 825, 2021 |
| 2 |
Binding Competition to the POPG Lipid Bilayer of Ca2+, Mg2+, Na+, and K+ in Different Ion Mixtures and Biological Implication
Mao YY, Du Y, Cang XH, Wang JA, Chen ZX, Yang HY, Jiang HL
Journal of Physical Chemistry B, 117(3), 850, 2013 |
| 3 |
Mapping the Functional Binding Sites of Cholesterol in beta(2)-Adrenergic Receptor by Long-Time Molecular Dynamics Simulations
Cang XH, Du Y, Mao YY, Wang YY, Yang HY, Jiang HL
Journal of Physical Chemistry B, 117(4), 1085, 2013 |
| 4 |
Relative Stability of Different DNA Guanine Quadruplex Stem Topologies Derived Using Large-Scale Quantum-Chemical Computations
Sponer J, Mladek A, Spackova N, Cang XH, Cheatham TE, Grimme S
Journal of the American Chemical Society, 135(26), 9785, 2013 |
| 5 |
Conformational Transition and Energy Landscape of ErbB4 Activated by Neuregulin1 beta: One Microsecond Molecular Dynamics Simulations
Du Y, Yang HY, Xu YC, Cang XH, Luo C, Mao YY, Wang YY, Qin GR, Luo XM, Jiang HL
Journal of the American Chemical Society, 134(15), 6720, 2012 |
| 6 |
Insight into G-DNA Structural Polymorphism and Folding from Sequence and Loop Connectivity through Free Energy Analysis
Cang XH, Sponer J, Cheatham TE
Journal of the American Chemical Society, 133(36), 14270, 2011 |
