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Journal of Chemical Theory and Computation, ISSN 1549-9618, 02/2014, Volume 10, Issue 2, pp. 865 - 879
The AMBER lipid force field has been updated to create Lipid14, allowing tensionless simulation of a number of lipid types with the AMBER MD package. The... 
CHAIN DYNAMICS | NUCLEAR-MAGNETIC-RESONANCE | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | ORDER PARAMETERS | CHEMISTRY, PHYSICAL | X-RAY-SCATTERING | H-2 NMR | MOLECULAR-DYNAMICS SIMULATIONS | PHOSPHOLIPID-BILAYERS | LATERAL DIFFUSION | QUANTITATIVE-DETERMINATION | MEMBRANE-LIPIDS
Journal Article
JOURNAL OF PHYSICAL CHEMISTRY B, ISSN 1520-6106, 08/2019, Volume 123, Issue 30, pp. 6515 - 6520
Bilayer lipid membranes (BLMs) are used as basic frameworks for biosensors and biohybrid devices due to their unique properties, which include ultrathin... 
GOLD NANOPARTICLES | SURFACE | CRYSTALS | CHEMISTRY, PHYSICAL | MONOLAYER | PHOSPHOLIPID-BILAYERS | CARBON NANOTUBES | Index Medicus
Journal Article
Nature Nanotechnology, ISSN 1748-3387, 06/2008, Volume 3, Issue 6, pp. 363 - 368
Journal Article
ACCOUNTS OF CHEMICAL RESEARCH, ISSN 0001-4842, 12/2013, Volume 46, Issue 12, pp. 2763 - 2772
Controlled translocation of molecules and ions across lipid membranes is the basis of numerous biological functions. Because synthetic systems can help... 
HYDROPHILIC MOLECULES | ANION RECEPTORS | LIPID-BILAYERS | ACIDS | GLUCOSE | FOLDAMERS | MICELLES | AMPHIPHILIC MOLECULAR BASKETS | SYNTHETIC ION CHANNELS | PHOSPHOLIPID-BILAYERS | CHEMISTRY, MULTIDISCIPLINARY
Journal Article
JOURNAL OF PHYSICAL CHEMISTRY B, ISSN 1520-6106, 03/2017, Volume 121, Issue 8, pp. 1802 - 1811
Melittin is a venom peptide that disrupts lipid bilayers at temperatures below the liquid-crystalline to gel phase transition temperature (Ta). Notably, the... 
SELF-ASSOCIATION | BOMBOLITIN II | FUSION | SPECTROSCOPY | VESICLES | MEMBRANE | CHEMISTRY, PHYSICAL | CONFORMATION | C-13 NMR | PHOSPHOLIPID-BILAYERS | PEPTIDE
Journal Article
Journal of Chemical Theory and Computation, ISSN 1549-9618, 11/2012, Volume 8, Issue 11, pp. 4593 - 4609
Molecular dynamics simulations provide a route to studying the dynamics of lipid bilayers at atomistic,or near, atomistic resolution. Over the past 10 years or... 
ELECTROSTATIC INTERACTIONS | COARSE-GRAINED SIMULATIONS | AMYLOID BETA-PEPTIDE | LIPID-BILAYERS | PROTEIN SIMULATIONS | PSEUDOMONAS-AERUGINOSA | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | POTENTIAL FUNCTIONS | PHOSPHOLIPID-BILAYERS | LATERAL DIFFUSION | FLUORESCENCE RECOVERY
Journal Article
Journal of Chemical Theory and Computation, ISSN 1549-9618, 03/2009, Volume 5, Issue 3, pp. 615 - 626
United-atom force fields for molecular dynamics (MID) simulations provide a higher computational efficiency, especially in lipid membrane simulations, with... 
GLYCOPHORIN-A | NA+ COUNTERIONS | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | FORCE-FIELD | GROMOS96 | PARTICLE MESH EWALD | PARAMETERS | MEMBRANE-PROTEINS | PHOSPHOLIPID-BILAYERS | SURFACE-TENSION | DIPALMITOYLPHOSPHATIDYLCHOLINE
Journal Article
Chemistry and Physics of Lipids, ISSN 0009-3084, 03/2019, Volume 219, pp. 36 - 44
Glucagon is a 29 amino acid peptide hormone secreted by pancreatic α−cells and interacts with specific receptors located in various organs. Glucagon tends to... 
Fibrillation mechanism | Glucagon | Bicelle | C solid-state NMR | Fibrillation kinetics | Phospholipid bilayers
Journal Article
Chemistry and Physics of Lipids, ISSN 0009-3084, 03/2019, Volume 219, pp. 36 - 44
Glucagon is a 29 amino acid peptide hormone secreted by pancreatic α−cells and interacts with specific receptors located in various organs. Glucagon tends to... 
Fibrillation mechanism | Glucagon | 13C solid-state NMR | Bicelle | Fibrillation kinetics | Phospholipid bilayers
Journal Article
Physical Review Letters, ISSN 0031-9007, 07/2016, Volume 117, Issue 4, pp. 048001 - 048001
We investigate the dielectric profile of water confined between two planar polar walls using atomistic molecular dynamics simulations. For a water slab... 
PERMITTIVITY | SELF-ASSEMBLED MONOLAYERS | PHYSICS, MULTIDISCIPLINARY | MICA SURFACES | HYDRATION FORCES | REPULSION | AQUEOUS-ELECTROLYTE SOLUTIONS | MOLECULAR-DYNAMICS SIMULATIONS | DOUBLE-LAYER | PHOSPHOLIPID-BILAYERS | POLAR FLUIDS | Water chemistry | Confinement | Asymmetry | Simulation | Molecular dynamics | Dielectrics | Slabs | Walls
Journal Article
Langmuir, ISSN 0743-7463, 03/2018, Volume 34, Issue 10, pp. 3349 - 3362
Antimicrobial peptide magainin 2 forms pores in lipid bilayers, a property that is considered the main cause of its bactericidal activity. Recent data suggest... 
LARGE UNILAMELLAR VESICLES | TRANSLOCATION | TRANSBILAYER MOVEMENT | MATERIALS SCIENCE, MULTIDISCIPLINARY | MEMBRANES | CHEMISTRY, PHYSICAL | TENSION | CHEMISTRY, MULTIDISCIPLINARY | FLIP-FLOP | LIPID-BILAYERS | EXCHANGE | PHOSPHOLIPID-BILAYERS | GIANT VESICLES | Index Medicus
Journal Article
BIOPHYSICAL JOURNAL, ISSN 0006-3495, 01/2018, Volume 114, Issue 2, pp. 392 - 399
A membrane-bound form of Pf1 coat protein reconstituted in magnetically aligned DMPC/DHPC bicelles was used as a molecular probe to quantify for the viscosity... 
SLOW MOTIONS | COAT PROTEIN | BIOPHYSICS | SOLID-STATE NMR | SPECTROSCOPY | ORIENTATION | NUCLEAR-MAGNETIC-RESONANCE | CROSS-POLARIZATION | DIFFUSION | PHOSPHOLIPID-BILAYERS | BICELLES
Journal Article
Nature Communications, ISSN 2041-1723, 08/2015, Volume 6, Issue 1, pp. 8052 - 8052
Journal Article
Organic and Biomolecular Chemistry, ISSN 1477-0520, 2007, Volume 5, Issue 11, pp. 1669 - 1678
Journal Article