Investigation of the interface in silica-encapsulated liposomes by combining solid state NMR and first principles calculations

Journal of the American Chemical Society

Volumn 133, Issue 42, 2011, Pages 16815-16827

  Folliet, Nicolas ^a   Roiland, Claire ^a,d   Bégu, Sylvie ^b   Aubert, Anne ^b   Mineva, Tzonka ^b   Goursot, Annick ^b   Selvaraj, Kaliaperumal ^b,e   Duma, Luminita ^c   Tielens, Frederik ^a   Mauri, Francesco ^a   Laurent, Guillaume ^a   Bonhomme, Christian ^a   Gervais, Christel ^a   Babonneau, Florence ^a   Azaïs, Thierry ^a  

^a SORBONNE UNIVERSITÉ   (France)

^b CNRS   (France)

^c ECOLE NORMALE SUPÉRIEURE   (France)

^d INSTITUT DES SCIENCES CHIMIQUES DE RENNES   (France)

^e NATIONAL CHEMICAL LABORATORY   (India)

Author keywords

[No Author keywords available]

Indexed keywords

AMORPHOUS SILICA; CHEMICAL ENVIRONMENT; CHEMICAL SHIFT ANISOTROPY; CROSS POLARIZATIONS; DEGRADABILITY; DFT CALCULATION; DIPALMITOYL PHOSPHATIDYLCHOLINE; DRUG STORAGE; FIRST-PRINCIPLES; FIRST-PRINCIPLES CALCULATION; FIRST-PRINCIPLES GEOMETRY; GEOMETRY OPTIMIZATION; H-BONDED; HEAD GROUPS; HYDROXYLATED SILICA; INTRINSIC PROPERTY; LOCAL DYNAMICS; MAS NMR; ORGANIC-INORGANIC HYBRID; ORGANIC/INORGANIC INTERFACES; PRESENCE OF WATER; PROJECTED AUGMENTED WAVES; REALISTIC MODEL; SILANOLS; SILICA SURFACE; SOLID STATE NMR; VIENNA AB-INITIO SIMULATION PACKAGES; WATER LAYERS;

CALCULATIONS; CHEMICAL SHIFT; COMPUTER SIMULATION; GEOMETRY; LIGHT POLARIZATION; LIPOSOMES; MEDICAL NANOTECHNOLOGY; MOLECULAR DYNAMICS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; OPTIMIZATION; PHOSPHOLIPIDS; PROTECTIVE COATINGS; SILICA;

INTERFACES (MATERIALS);

DIPALMITOYLPHOSPHATIDYLCHOLINE; LIPOSOME; PHOSPHATE; PHOSPHOLIPID; PHOSPHORUS 31; PROTON; SILANOL; SILICON DIOXIDE; WATER;

ANISOTROPY; ARTICLE; CHEMICAL ENVIRONMENT; CHEMICAL INTERACTION; GEOMETRY; HYDROGEN BOND; HYDROXYLATION; MOLECULAR DYNAMICS; MOLECULAR STABILITY; NANOENCAPSULATION; NUCLEAR MAGNETIC RESONANCE; POLARIZATION; SOLID STATE;

CAPSULES; LIPOSOMES; MICROSCOPY, ELECTRON, SCANNING; MOLECULAR STRUCTURE; QUANTUM THEORY; SILICON DIOXIDE; SURFACE PROPERTIES;

EID: 80054979829     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja201002r     Document Type: Article

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