Characterisation of complex organic matter present in contaminated sediments from water retention ponds Fulltext Access 12 Pages 2005
Recycling of low-density polyethylene and polypropylene via copyrolysis of polyalkene oil/waxes with naphtha: product distribution and coke formation Fulltext Access 12 Pages 2005
The prediction of the effects of tobacco type on smoke composition from the pyrolysis modeling of tobacco shreds Fulltext Access 12 Pages 2005
MS2Grouper: Group Assessment and Synthetic Replacement of Duplicate Proteomic Tandem Mass Spectra Fulltext Access 12 Pages 2005
Novel CFCs-Substitutes Recommended by EPA (Hydrofluorocarbon-245fa and Hydrofluoroether-7100): Ion Chemistry in Air Plasma and Reactions with Atmospheric Ions Fulltext Access 12 Pages 2005
Fragmentation Pathway for Glutamine Identification: Loss of 73 Da from Dimethylformamidine Glutamine Isobutyl Ester Fulltext Access 12 Pages 2005
Temperature dependence of the optical properties of liquid toluene between 4000 and 400 cmâ1 from 30 to 105 °C Fulltext Access 13 Pages 2005
Identification of chiral selectors for improved enantioseparation based on molecular interaction fields Fulltext Access 13 Pages 2005
Monitoring arsenic in the environment: a review of science and technologies with the potential for field measurements Fulltext Access 13 Pages 2005
Uncertainty propagation through correction methodology for the determination of rare earth elements by quadrupole based inductively coupled plasma mass spectrometry Fulltext Access 13 Pages 2005
Characterization of iron(II)(α-diimine) chelates and their interactions with anionic, cationic and non-ionic micelles using the separation, spectrophotometric and computational methods Fulltext Access 13 Pages 2005
Spectroscopic, spectrometric and PM5 semiempirical investigation of new lasalocid 8-hydroxy-3,6-dioxaoctyl ester and its complexes with monovalent cations Fulltext Access 13 Pages 2005
Raman, infrared and far infrared spectra, ab initio calculations, r0 structural parameters, and internal rotation of 3-methyl-1-butyne Fulltext Access 13 Pages 2005
Red-shifted and improper blue-shifted hydrogen bonds in dimethyl ether (DME)n (n=1-4) and hydrated (DME)n (n=1-4) clusters. A theoretical study Fulltext Access 13 Pages 2005
UV resonance Raman study of model complexes of the CuB site of cytochrome c oxidase Fulltext Access 13 Pages 2005
Ab initio and DFT theoretical studies of pyridoxal-5â²-phosphate methylamine Schiff base isomers Fulltext Access 13 Pages 2005
The Cologne Database for Molecular Spectroscopy, CDMS: a useful tool for astronomers and spectroscopists Fulltext Access 13 Pages 2005
Structural influence on the intermolecular/intramolecular hydrogen bonding in solid state of substituted leflunomides: evidence by X-ray crystal structure Fulltext Access 13 Pages 2005
High resolution ICPMS as an on-line detector for flow field-flow fractionation; multi-element determination of colloidal size distributions in a natural water sample Fulltext Access 13 Pages 2005
Determination of the energetic value of fruit and milk-based beverages through partial-least-squares attenuated total reflectance-Fourier transform infrared spectrometry Fulltext Access 13 Pages 2005
Using electrospray ionization-mass spectrometry/tandem mass spectrometry and small molecules to study guanidinium-anion interactions Fulltext Access 13 Pages 2005
Inductively coupled plasma mass spectrometry (ICP-MS) and laser ablation ICP-MS for isotope analysis of long-lived radionuclides Fulltext Access 13 Pages 2005
Structure determination of gaseous metal and semi-metal cluster ions by ion mobility spectrometry Fulltext Access 13 Pages 2005
Automatic masking in multivariate image analysis using support vector machines Fulltext Access 13 Pages 2005
Threshold dissociation and molecular modeling of transition metal complexes of flavonoids Fulltext Access 13 Pages 2005
Binary mixture pyrolysis of polypropylene and polystyrene: A modeling and experimental study Fulltext Access 13 Pages 2005
Non-isothermal kinetic studies on co-processing of vacuum residue, plastics, coal and petrocrop Fulltext Access 13 Pages 2005
Binding of a Diphosphorylated-ITAM Peptide to Spleen Tyrosine Kinase (Syk) Induces Distal Conformational Changes: A Hydrogen Exchange Mass Spectrometry Study Fulltext Access 13 Pages 2005
Peptide Mass Mapping of Acetylated Isoforms of Histone H4 from Mouse Lymphosarcoma Cells Treated with Histone Deacetylase (HDACs) Inhibitors Fulltext Access 13 Pages 2005
Mass Spectrometric Studies of the Gas Phase Retro-Michael Type Fragmentation Reactions of 2-Hydroxybenzyl-N-Pyrimidinylamine Derivatives Fulltext Access 13 Pages 2005
Experimental and Theoretical Investigations of the Loss of Amino Acid Side Chains in Electron Capture Dissociation of Model Peptides Fulltext Access 13 Pages 2005
Studies on Phosphatidylserine by Tandem Quadrupole and Multiple Stage Quadrupole Ion-Trap Mass Spectrometry with Electrospray Ionization: Structural Characterization and the Fragmentation Processes Fulltext Access 13 Pages 2005
Direct Correlation of the Crystal Structure of Proteins with the Maximum Positive and Negative Charge States of Gaseous Protein Ions Produced by Electrospray Ionization Fulltext Access 13 Pages 2005
Investigation of the Initial Fragmentation of Oligodeoxynucleotides in a Quadrupole Ion Trap: Charge Level-Related Base Loss Fulltext Access 13 Pages 2005
A Novel Mass Spectrometric Method to Distinguish Isobaric Monosaccharides that are Phosphorylated or Sulfated Using Ion-Pairing Reagents Fulltext Access 13 Pages 2005
Ensemble methods and data augmentation by noise addition applied to the analysis of spectroscopic data Fulltext Access 13 Pages 2005
A Comparison of Data Analysis Methods for Determining Gas Phase Stabilities by CID: Alkali Metal Complexes of Polyether Ionophore Antibiotics Fulltext Access 13 Pages 2005
Fragmentation of Negative Ions from Carbohydrates: Part 3. Fragmentation of Hybrid and Complex N-Linked Glycans Fulltext Access 13 Pages 2005
The Structure of Gas-Phase Bradykinin Fragment 1-5 (RPPGF) Ions: An Ion Mobility Spectrometry and H/D Exchange Ion-Molecule Reaction Chemistry Study Fulltext Access 13 Pages 2005
Use of NIR spectroscopy and chemometrics for on-line process monitoring of ammonia in Low Methoxylated Amidated pectin production Fulltext Access 13 Pages 2005
A chemometrics investigation of sugarcane plant properties based on the molecular composition of epicuticular wax Fulltext Access 13 Pages 2005
Background removal from spectra by designing and minimising a non-quadratic cost function Fulltext Access 13 Pages 2005
Fault detection and identification of nonlinear processes based on kernel PCA Fulltext Access 13 Pages 2005
Multivariate data analysis in classification of vegetable oils characterized by the content of fatty acids Fulltext Access 13 Pages 2005
Room temperature acid sonication ICP-MS multielemental analysis of milk Fulltext Access 13 Pages 2005
Ultrafast solvent response upon a change of the solute size in non-polar supercritical fluids Fulltext Access 13 Pages 2005
Dielectric resonator-based resonant structure for sensitive ESR measurements at high-hydrostatic pressures Fulltext Access 13 Pages 2005
Maximum entropy: A complement to Tikhonov regularization for determination of pair distance distributions by pulsed ESR Fulltext Access 13 Pages 2005
Application of the out-of-phase absorption mode to separating overlapping EPR signals with different T1 values Fulltext Access 13 Pages 2005
Diagnostic analysis of experimental artefacts in DOSY NMR data by covariance matrix of the residuals Fulltext Access 13 Pages 2005
Active shielding of cylindrical saddle-shaped coils: Application to wire-wound RF coils for very low field NMR and MRI Fulltext Access 13 Pages 2005
Dating unheated quartz using a single aliquot regeneration-dose red thermoluminescence protocol (SAR RTL) Fulltext Access 13 Pages 2005
Ultrafast dissociation processes in the NO dimer studied with time-resolved photoelectron imaging Fulltext Access 13 Pages 2005
Reflected electron energy loss microscopy (REELM) studies of metals, semiconductors and insulators Fulltext Access 13 Pages 2005
Absorption and emission spectroscopic characterisation of the LOV2-His domain of phot from Chlamydomonas reinhardtii Fulltext Access 13 Pages 2005
The proton nuclear magnetic shielding tensors in biphenyl: Experiment and theory Fulltext Access 13 Pages 2005
Theoretical designing of the electronic structures and conduction properties of copolymers of donor-acceptor polymers: effect of multi-neighbour interaction Fulltext Access 13 Pages 2005
Fine-structure vibronic spectra and NH-phototautomerism in free-base unsubstituted 2,3-naphthalocyanine in naphthalene at 6 K Fulltext Access 13 Pages 2005
Ab-initio study of the electronic factor (Î) conformational dependence in [CH2-(phenylene)n-CH2]â electron transfer model systems Fulltext Access 13 Pages 2005
Infrared spectra calculated by quantum chemistry with anharmonic corrections: Application to hydrogen-bonded complexes of nitric acid with various bases Fulltext Access 13 Pages 2005
Interaction of poly (ethylene oxide)-poly (propylene oxide)-poly (ethylene oxide) triblock copolymer of molecular weight 2800 with sodium dodecylsulfate (SDS) micelles: some physicochemical studies Fulltext Access 13 Pages 2005
Photosensitization of thin SnO2 nanocrystalline semiconductor film electrodes with electron donor-acceptor metallodiporphyrin dyad Fulltext Access 13 Pages 2005
DFT study on the influence of meso-phenyl substitution on the geometric, electronic structure and vibrational spectra of free base porphyrin Fulltext Access 13 Pages 2005
Absorption and fluorescence spectroscopic characterization of BLUF domain of AppA from Rhodobacter sphaeroides Fulltext Access 13 Pages 2005
Size dependence investigations of hot electron cooling dynamics in metal/adsorbates nanoparticles Fulltext Access 13 Pages 2005
Evolution of solid state systems containing mutually coupled dipolar and quadrupole spins: Perturbation treatment Fulltext Access 13 Pages 2005
Elimination of matrix effects for headspace solid-phase microextraction of important volatile compounds in red wine using a novel coating Fulltext Access 13 Pages 2005
The thermodynamic dissociation constants of haemanthamine, lisuride, metergoline and nicergoline by the regression analysis of spectrophotometric data Fulltext Access 13 Pages 2005
A straightforward separation scheme for concomitant Lu-Hf and Sm-Nd isotope ratio and isotope dilution analysis Fulltext Access 13 Pages 2005
Feedback and feedforward control of wet-processed hardboard production using spectroscopy and chemometric modelling Fulltext Access 13 Pages 2005
Classification of PDO olive oils on the basis of their sterol composition by multivariate analysis Fulltext Access 13 Pages 2005
Pressurized liquid extraction using water/isopropanol coupled with solid-phase extraction cleanup for semivolatile organic compounds, polycyclic aromatic hydrocarbons (PAH), and alkylated PAH homolog groups in sediment Fulltext Access 13 Pages 2005
Spectra calculations in central and wing regions of CO2 IR bands. IV: software and database for the computation of atmospheric spectra Fulltext Access 13 Pages 2005
Solid-state NMR characterisation of the thermal transformation of a Hungarian white illite Fulltext Access 13 Pages 2005
High-speed 1H MAS NMR investigations of the weathered surface of a phosphate glass Fulltext Access 13 Pages 2005
A high-resolution 19F NMR spectroscopic study of barium fluorozirconate glasses and related crystals Fulltext Access 13 Pages 2005
Site connectivities in sodium aluminoborate glasses: multinuclear and multiple quantum NMR results Fulltext Access 13 Pages 2005
A priori evaluation of the solvent contribution to the reorganization energy accompanying intramolecular electron transfer: Predicting the nature of the Creutz-Taube ion Fulltext Access 13 Pages 2005
Versatility of the dipolar filter selection: From 1H nuclear spin diffusion experiment to the measurement of nuclear Overhauser effect in homopolymer melts Fulltext Access 13 Pages 2005
The high-resolution infrared spectrum of isoxazole vapor between 800 and 1700Â cmâ1 Fulltext Access 13 Pages 2005
High-resolution FTIR measurement of the 2ν8 band of methylene fluoride (CH2F2) Fulltext Access 13 Pages 2005
Time-resolved Fourier transform infrared spectroscopy: Application to pulsed discharges Fulltext Access 13 Pages 2005
The 5νNH and 5νND vibrational bands of partially deuterated ammonia species Fulltext Access 13 Pages 2005
A high-resolution infrared study of five bands of 1,2,5-thiadiazole in the range 750-1250Â cmâ1, together with ab initio and DFT studies Fulltext Access 13 Pages 2005
Rotational spectrum of trans-trans diethyl ether in the ground and three excited vibrational states Fulltext Access 13 Pages 2005
Missing first points and phase artifact mutually entangled in FT NMR data-noniterative solution Fulltext Access 13 Pages 2005
Computer simulation studies of the effects of dynamic shimming on susceptibility artifacts in EPI at high field Fulltext Access 13 Pages 2005