Conformations and dynamics of adsorbed protein-like chains
Keywords: سازگاری; Conformation; Protein-like chain; Adsorption;
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Conformational analysis of p-terphenyl by vibrational spectroscopy and density functional theory calculations
Keywords: سازگاری; Density functional theory calculations; Vibrational spectroscopy; Conformation; p-Terphenyl;
A comparative study of sparteine, α-isosparteine and 2-methylsparteine monoperchlorate salts and zinc (II) complexes by NMR chemical shifts
Keywords: سازگاری; Bis-quinolizidine alkaloids; Zinc(II) complexes; 13C NMR; 1H NMR; Conformation; Protonation effects; Complexation effects;
On the optical properties of thiophene oligomers: configuration interaction study on their ground (S0) and first singlet excited (S1) states
Keywords: سازگاری; Oligothiophenes; Conformation; Excited state; Optical property;
Conformational study of 'Cis and trans' N-formyl-N-methyl-l-glycine-Nâ²-amide and N-acetyl-N-methyl-l-glycine-Nâ²-methylamide. An ab-initio and DFT study
Keywords: سازگاری; Conformation; N-methyl-l-glycine-N-methyllamine; Ab-initio and DFT calculations; Sarcosine;
Infrared and Raman spectra and quantum chemistry calculations for 2,2,2-trifluoroethyl trichloromethanesulfonate, CCl3SO2OCH2CF3
Keywords: سازگاری; DFT calculations; Infrared spectra; Raman spectra; Conformation; 2,2,2-Trifluoroethyl trichlororomethanesulfonate;
Conformational study of erythritol and threitol in the gas state by density functional theory calculations
Keywords: سازگاری; Erythritol; Threitol; Conformation; DFT; Intramolecular H-bonds; Enthalpy; Gibbs energy;
Enantiomerically pure 4-amino-1,2,3-trihydroxybutylphosphonic acids
Keywords: سازگاری; Amino acids and derivatives; Aldehydes; Configuration; Conformation; Phosphonic acids and derivatives;
Synthesis, X-ray crystallographic, and dynamic 1H NMR studies of crown-tetrathia[3.3.3.3]metacyclophanes-conformational control by cooperative intramolecular C-Hâ¯Ï interaction both in solid state and in solution
Keywords: سازگاری; Synthesis; Cyclophane; C-Hâ¯Ï Interaction; Conformation;
Substituent effects in the ring-chain tautomerism of 4-aryl-1,3,4,6,7,11b-hexahydro-2H-pyrimido[6,1-a]isoquinolines
Keywords: سازگاری; Diamines; Isoquinolines; Hexahydropyrimidines; Ring-chain tautomerism; Conformation;
Conformational behavior of dithia[n.3.3](1,3,5)cyclophanes and dithia[n.3.3](1,2,6)cyclophanes
Keywords: سازگاری; Conformation; (1,3,5)Cyclophane; (1,2,6)Cyclophane;
The external-anomeric torsional effect
Keywords: سازگاری; External-anomeric torsional effect; MM4; Ab initio; Dimethoxymethane; 2,4-Dioxahexane; Disaccharide; Conformation;
Synthesis and structural characterization of metal halide complexes containing N,Nâ²-di(2-methoxyphenyl)formamidine (o-HDMophF)
Keywords: سازگاری; Metal halide complexes; Conformation; X-ray structure; Hydrogen bonds; N,Nâ²-Di(2-methoxyphenyl)formamidine;
Investigation of the Flocculation of Colloidal Suspensions by Controlling Adsorbed Layer Microstructure and Population Balance Modelling
Keywords: سازگاری; colloidal suspensions; flocculation; polymer; conformation; population balance modelling; surface forces;
Chemisorption of thiolated poly(ethylene oxide) to gold: surface chain densities measured by ellipsometry and neutron reflectometry
Keywords: سازگاری; Ellipsometry; XPS; Poly(ethylene oxide); Chemisorption; Conformation; Cloud point; Surface chain density; Neutron reflectometry;
Apical uptake and transepithelial transport of sphingosine monomers through intact human intestinal epithelial cells: Physicochemical and molecular modeling studies
Keywords: سازگاری; Sphingolipid; Intestinal absorption; Lipid raft; Energy; Conformation; Unstirred water layer; Micelle; Plasma membrane; Cholesterol;
Characterization of a dimeric unfolding intermediate of bovine serum albumin under mildly acidic condition
Keywords: سازگاری; 1-ANS; 1-anilino 8-naphthylene sulfonic acid; BAL; sodium arsenite; BSA; Bovine serum albumin; CD; Circular dichroism; DTNB; dithio bis-trinitrobenzoic acid; NBD-Cl; 4-chloro-7-nitrobenzo-2-oxa-1,3-diazole; NEM; N-ethyl maleimide; MMTS; methyl methane thi
Molecular modeling of the H-bonds in polyurethane with multiple donors and acceptors
Keywords: سازگاری; Polyurethanes; H-bond; Conformation;
Crystal structure of a novel phospholipase A2 from Naja naja sagittifera with a strong anticoagulant activity
Keywords: سازگاری; Phospholipase A2; Naja naja sagittifera; Anticoagulant; Sequence; X-ray structure; Conformation;
The influence of halide anions on the molecular structure of bis(N-methylpiperidine betaine) monocation with short hydrogen bond
Keywords: سازگاری; Bis(N-methylpiperidine betaine) hydrohalides; Bis(1-methyl-cyclohexyl)acetate)Hâ anion; Short O·H·O hydrogen bond; Weak C-Hâ¯O and C-Hâ¯Xâ hydrogen bonds; X-ray diffraction; FTIR and NMR spectra; B3LYP/6-31G(d,p) calculations; Conformation;
Comparative structural analysis of low-molecular mass fragments of Rapana venosa hemocyanin obtained using two different procedures
Keywords: سازگاری; Hc; Functional unit; SAXS; Low-resolution models; Size exclusion chromatography; Proteolysis; Conformation;
Synthesis of 4,8-anhydro-d-glycero-d-ido-nonanitol 1,6,7-trisphosphate as a novel IP3 receptor ligand using a stereoselective radical cyclization reaction based on a conformational restriction strategy
Keywords: سازگاری; C-Glycosides; Conformation; Fleming oxidation; Inositol trisphosphate; Radical reactions;
Two polymorphs of 4-hydroxy-1-methylpiperidine betaine hydrochloride studied by X-ray and DFT methods
Keywords: سازگاری; N-methylpiperidine betaine; X-ray diffraction; DFT calculations; Hydrogen bonds; Polymorphic crystals; Conformation;
Excited state dynamics of a conformationally disordered conjugated polymer: A comparison of solutions and film
Keywords: سازگاری; Conjugated polymers; MEH-PPV; Disorder; 3PEPS; Dynamic localization; Conjugation length; Conformation;
Mutations increasing exposure of a receptor binding site epitope in the soluble and oligomeric forms of the caprine arthritis-encephalitis lentivirus envelope glycoprotein
Keywords: سازگاری; Lentivirus; Glycoprotein; Receptor; CAEV; HIV-1; Rotamer; Conformation; Entrapy; Neutralization; Neutralization-resistance;
The relationship between body dimensions of living pigs and their carcass composition
Keywords: سازگاری; Pigs; Body shape; Visual image analysis; Conformation; Carcass composition;
Genetics of Parity-Dependant Production Increase and its Relationship with Health, Fertility, Longevity, and Conformation in Swiss Holsteins
Keywords: سازگاری; production increase; maturity rate; functional trait; conformation; DFS; days to first service; ECM; energy-corrected milk; ECMI; production increase for energy-corrected milk; ECMIij; production increase for energy-corrected milk from lactation i to j; I
The C-terminal tail of the gp41 transmembrane envelope glycoprotein of HIV-1 clades A, B, C, and D may exist in two conformations: an analysis of sequence, structure, and function
Keywords: سازگاری; HIV-1; Envelope protein; gp41 envelope protein; gp41 C-terminal tail; Structure; Conformation; Membrane spanning domain; Tyrosine-sorting signal;
Hyaluronan conformations on surfaces: effect of surface charge and hydrophobicity
Keywords: سازگاری; Hyaluran; Polysaccharide; Atomic force microscopy; Graphite; Conformation; Surface;
Towards understanding the interaction between oligosaccharides and water molecules
Keywords: سازگاری; Molecular dynamics; Oligosaccharide; Mannose; Conformation; Water;
Challenges for the modern analytical ultracentrifuge analysis of polysaccharides
Keywords: سازگاری; Conformation; Interaction; Velocity; Equilibrium; SEDFIT; MSTAR;
The disordered conformation of κ-carrageenan in solution as determined by NMR experiments and molecular modeling
Keywords: سازگاری; Carrageenan; Structure; NMR; NOESY; Molecular modeling; Conformation;