| 1 |
Binding of SV40's Viral Capsid Protein VP1 to Its Glycosphingolipid Receptor GM1 Induces Negative Membrane Curvature: A Molecular Dynamics Study
Kociurzynski R, Beck SD, Bouhon JB, Romer W, Knecht V
Langmuir, 35(9), 3534, 2019 |
| 2 |
Structure Formation in Langmuir Peptide Films As Revealed from Coarse-Grained Molecular Dynamics Simulations
Knecht V, Reiter G, Schlaad H, Reiter R
Langmuir, 33(26), 6492, 2017 |
| 3 |
Thermodynamic Origin of Multilayer Structures in Langmuir Polymer Films
Knecht V, Reiter G, Reiter R
Langmuir, 33(42), 11399, 2017 |
| 4 |
Free Energy of Lipid Bilayer Defects Affected by Alzheimer's Disease-Associated Amyloid-beta(42) Monomers
Pobandt T, Knecht V
Journal of Physical Chemistry B, 118(13), 3507, 2014 |
| 5 |
Long-Range Conformational Transition of a Photoswitchable Allosteric Protein: Molecular Dynamics Simulation Study
Buchenberg S, Knecht V, Walser R, Hamm P, Stock G
Journal of Physical Chemistry B, 118(47), 13468, 2014 |
| 6 |
Standard Gibbs energies of formation and equilibrium constants from ab-initio calculations: Covalent dimerization of NO2 and synthesis of NH3
Awasthi N, Ritschel T, Lipowsky R, Knecht V
Journal of Chemical Thermodynamics, 62, 211, 2013 |
| 7 |
Importance of Polar Solvation and Configurational Entropy for Design of Antiretroviral Drugs Targeting HIV-1 Protease
Kar P, Lipowsky R, Knecht V
Journal of Physical Chemistry B, 117(19), 5793, 2013 |
| 8 |
Origin of Decrease in Potency of Darunavir and Two Related Antiviral Inhibitors against HIV-2 Compared to HIV-1 Protease
Kar P, Knecht V
Journal of Physical Chemistry B, 116(8), 2605, 2012 |
| 9 |
Mutation-Induced Loop Opening and Energetics for Binding of Tamiflu to Influenza N8 Neuraminidase
Kar P, Knecht V
Journal of Physical Chemistry B, 116(21), 6137, 2012 |
| 10 |
Energetics of Mutation-Induced Changes in Potency of Lersivirine against HIV-1 Reverse Transcriptase
Kar P, Knecht V
Journal of Physical Chemistry B, 116(22), 6269, 2012 |
