Serveur d'exploration sur la musique en Sarre

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Abstracts of publications related to QSAR

Identifieur interne : 001257 ( Main/Exploration ); précédent : 001256; suivant : 001258

Abstracts of publications related to QSAR

Auteurs :

Source :

RBID : ISTEX:322E0541B76F4F2AEFE08C62409B68AABD6AD64A

English descriptors


Url:
DOI: 10.1002/qsar.19910100111


Affiliations:


Links toward previous steps (curation, corpus...)


Le document en format XML

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<title level="j">Quantitative Structure‐Activity Relationships</title>
<title level="j" type="abbrev">Quant. Struct.‐Act. Relat.</title>
<idno type="ISSN">0931-8771</idno>
<idno type="eISSN">1521-3838</idno>
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<publisher>WILEY‐VCH Verlag</publisher>
<pubPlace>Weinheim</pubPlace>
<date type="published" when="1991">1991</date>
<biblScope unit="volume">10</biblScope>
<biblScope unit="issue">1</biblScope>
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<term>Abbott laboratories abbot park</term>
<term>Abstr</term>
<term>Acidic dissociation</term>
<term>Acrylate monomers</term>
<term>Active analog approach</term>
<term>Active conformation</term>
<term>Active site</term>
<term>Active site cavity</term>
<term>Adenosine</term>
<term>Adenosine deaminase</term>
<term>Adenosine derivatives</term>
<term>Agonist</term>
<term>Agonist site</term>
<term>Algorithm</term>
<term>Aliphatic</term>
<term>Aliphatic compounds</term>
<term>Ambient conditions</term>
<term>Amino</term>
<term>Amino acids</term>
<term>Analgesic potency</term>
<term>Analogue</term>
<term>Antispasmodic activity</term>
<term>Antitumor agents</term>
<term>Antitumor antibiotic porfiromycin</term>
<term>Aqueous solubility</term>
<term>Aqueous system</term>
<term>Aromatase</term>
<term>Aromatic</term>
<term>Aromatic ring</term>
<term>Aromatic rings</term>
<term>Atomic coordinates</term>
<term>Axonal membrane</term>
<term>Azabicycloalkyl moieties</term>
<term>Backbone torsional angles</term>
<term>Benzodiazepine</term>
<term>Benzodiazepine derivatives</term>
<term>Benzodiazepine receptor</term>
<term>Benzodiazepine receptor ligands</term>
<term>Bile acids</term>
<term>Binding affinity</term>
<term>Binding site cavity</term>
<term>Biological activities</term>
<term>Biological activity</term>
<term>Biological activity values</term>
<term>Biological material</term>
<term>Biomedicinal chemistry</term>
<term>Blaise pascal</term>
<term>Bond angles</term>
<term>Cancer research campaign biomolecular structure unit</term>
<term>Capacity factor</term>
<term>Carbon atoms</term>
<term>Carbony1 group</term>
<term>Carbonyl</term>
<term>Carbonyl group</term>
<term>Cation concentration</term>
<term>Central research division</term>
<term>Cephalosporin esters</term>
<term>Chem</term>
<term>Chemical compounds</term>
<term>Chemical descriptors</term>
<term>Chlorinated alkylbenzenes</term>
<term>Chromatographic retention indices</term>
<term>Clogp algorithm</term>
<term>Cluster analysis</term>
<term>Coefficient</term>
<term>Color coding</term>
<term>Color plates</term>
<term>Compound</term>
<term>Computer graphics</term>
<term>Conformation</term>
<term>Conformational</term>
<term>Conformational analysis</term>
<term>Conformational energies</term>
<term>Conformational search program</term>
<term>Conformers</term>
<term>Connectivity</term>
<term>Connectivity index</term>
<term>Contaminant concentration</term>
<term>Correlation analysis</term>
<term>Corresponding atoms</term>
<term>Crystal structure</term>
<term>Crystalline symmetry</term>
<term>Crystallographic studies</term>
<term>Data base</term>
<term>Deeper understanding</term>
<term>Depolarizing activity</term>
<term>Derivative</term>
<term>Descriptor</term>
<term>Diazepam receptor</term>
<term>Difference spectra</term>
<term>Different features</term>
<term>Different types</term>
<term>Diffraction analysis</term>
<term>Diffraction study</term>
<term>Diphenylmethane carbon</term>
<term>Distribution coefficients</term>
<term>Dohme research laboratories</term>
<term>Drug design</term>
<term>Dual grid</term>
<term>Dynamics structure</term>
<term>Edulinine analogues</term>
<term>Efficient algorithm</term>
<term>Electronic parameter</term>
<term>Electronic parameters</term>
<term>Electronwithdrawing power</term>
<term>Electrostatic interactions</term>
<term>Electrostatic recognition</term>
<term>Energy conformations</term>
<term>Energy conformers</term>
<term>Energy difference</term>
<term>Energy minimization</term>
<term>Enteric bacteria</term>
<term>Enzyme aromatase</term>
<term>Enzyme inhibitors</term>
<term>Enzymelinhibitor complexes</term>
<term>Enzymes aromatase</term>
<term>Estuarine organisms</term>
<term>Federal republic</term>
<term>Fine chemicals directory</term>
<term>Free base</term>
<term>Functional groups</term>
<term>General form</term>
<term>Gibbs energy</term>
<term>Good agreement</term>
<term>Graphical display</term>
<term>Graphics</term>
<term>Grid</term>
<term>Herbicidal phenylureas</term>
<term>Hexadecane</term>
<term>Human erythrocyte</term>
<term>Human leukocyte elastase</term>
<term>Human renin</term>
<term>Hydrophilic zone</term>
<term>Hydrophobic</term>
<term>Hydrophobic factor</term>
<term>Hydrophobic pocket</term>
<term>Hydrophobicity</term>
<term>Hypolipidemic activity</term>
<term>Icso</term>
<term>Imidazolinone herbicides</term>
<term>Imidazolinone ring</term>
<term>Inactivation domain</term>
<term>Inactive compounds</term>
<term>Inhibition</term>
<term>Inhibitor</term>
<term>Inhibitory activity</term>
<term>Izumi strains</term>
<term>Laevis embryos</term>
<term>Lewis lung carcinoma</term>
<term>Life span</term>
<term>Ligand</term>
<term>Linear regression equations</term>
<term>Lipophilic</term>
<term>Lipophilic zone</term>
<term>Lipophilicity</term>
<term>Liquid chromatography</term>
<term>Local density charge</term>
<term>Logarithm</term>
<term>Logk</term>
<term>Logp</term>
<term>Logp values</term>
<term>Lone electron pair</term>
<term>Lyase</term>
<term>Lysozyme substrate</term>
<term>Main features</term>
<term>Major approaches</term>
<term>Medicinal chemical research</term>
<term>Medicinal chemistry</term>
<term>Methyl ethers</term>
<term>Methyl group</term>
<term>Methyl groups</term>
<term>Michaelis inhibition</term>
<term>Minimum energy conformation</term>
<term>Minimum energy conformations</term>
<term>Modeling</term>
<term>Modeling study</term>
<term>Moiety</term>
<term>Molar</term>
<term>Molar concentration</term>
<term>Molar refractivity</term>
<term>Molecular</term>
<term>Molecular charge descriptors</term>
<term>Molecular connectivity indices</term>
<term>Molecular dynamics method</term>
<term>Molecular graph</term>
<term>Molecular graphics</term>
<term>Molecular mechanics</term>
<term>Molecular mechanics calculations</term>
<term>Molecular modeling</term>
<term>Molecular modeling studies</term>
<term>Molecular orbitals</term>
<term>Molecular sructures</term>
<term>Molecular structures</term>
<term>Molecular surface</term>
<term>Molecular surfaces</term>
<term>Molecular weight</term>
<term>Molecule</term>
<term>Mongrel dogs</term>
<term>Mosquito larvae</term>
<term>Multivariate analysis</term>
<term>Mutagenicity</term>
<term>Narrow cleft</term>
<term>Natural substrates</term>
<term>Negative logarithm</term>
<term>Nephotettix cincticeps</term>
<term>Neural network</term>
<term>Nitrogen atom</term>
<term>Nitrogen atoms</term>
<term>Nucleophilic superdelocalizability</term>
<term>Opioid peptides</term>
<term>Optimized structures</term>
<term>Organic matter</term>
<term>Organic solutes</term>
<term>Organische chemie</term>
<term>Orotic acid</term>
<term>Ortho substituents</term>
<term>Oxygen atoms</term>
<term>Parabolic</term>
<term>Parameter</term>
<term>Paris cedex</term>
<term>Partition</term>
<term>Partition coefficient</term>
<term>Partition coefficients</term>
<term>Partition function</term>
<term>Pattern recognition</term>
<term>Peptide</term>
<term>Pharm</term>
<term>Pharmaceutical products division</term>
<term>Pharmacophore</term>
<term>Pharmacophore model</term>
<term>Phase hplc</term>
<term>Phenyl</term>
<term>Phenyl ring</term>
<term>Phenyl rings</term>
<term>Physical chemistry</term>
<term>Physicochemical</term>
<term>Physicochemical properties</term>
<term>Picrotoxinin</term>
<term>Picrotoxinin receptor</term>
<term>Place jussieu</term>
<term>Polychlorinated biphenyls</term>
<term>Porcine pepsinogen</term>
<term>Porfiromycin</term>
<term>Potential energy surfaces</term>
<term>Principal component analysis</term>
<term>Principal components</term>
<term>Prorenin</term>
<term>Protein sequence analysis</term>
<term>Protein structure prediction</term>
<term>Protein surfaces</term>
<term>Purine</term>
<term>Purine ring</term>
<term>Qsar</term>
<term>Qsar study</term>
<term>Qualitative model</term>
<term>Quant</term>
<term>Quantitative analysis</term>
<term>Quantitative relationship models</term>
<term>Quantitative relationship studies</term>
<term>Quantitative relationships</term>
<term>Quantitative studies</term>
<term>Receptor</term>
<term>Receptor binding affinity</term>
<term>Receptor site</term>
<term>Refractivity</term>
<term>Regression</term>
<term>Regression analysis</term>
<term>Regression equation</term>
<term>Regression equations</term>
<term>Relat</term>
<term>Relative activities</term>
<term>Renin</term>
<term>Resonance effect</term>
<term>Retention factor</term>
<term>Ring systems</term>
<term>Salmonella</term>
<term>Salmonella typhimurium</term>
<term>Saskatchewan saskatoon</term>
<term>Second order rate</term>
<term>Selectivity</term>
<term>Separate equations</term>
<term>Serine protease</term>
<term>Serotonin</term>
<term>Serotonin receptor</term>
<term>Side chain</term>
<term>Significant correlation</term>
<term>Significant correlations</term>
<term>Significant equation</term>
<term>Significant parabolic regression equation</term>
<term>Significant parabolic regression equations</term>
<term>Significant regression equation</term>
<term>Smooth surface</term>
<term>Solid line</term>
<term>Solid solutes</term>
<term>Solubility</term>
<term>Solute</term>
<term>Solute pairs</term>
<term>Southern california</term>
<term>Space curve</term>
<term>Specific receptor ligands</term>
<term>Square deviation</term>
<term>Stable conformers</term>
<term>Staphylococcus aureus</term>
<term>Steric</term>
<term>Steric effects</term>
<term>Steric parameter</term>
<term>Sterimol steric parameters</term>
<term>Structural basis</term>
<term>Structural modifications</term>
<term>Structural requirements</term>
<term>Structure evaluation</term>
<term>Structure prediction</term>
<term>Substituent</term>
<term>Substituents</term>
<term>Substitution pattern</term>
<term>Substrate binding cleft</term>
<term>Substructural descriptors</term>
<term>Substructure</term>
<term>Substructure systems</term>
<term>Superimposition</term>
<term>Superoxide dismutase</term>
<term>Superposition</term>
<term>Surface neighborhood</term>
<term>Symmetric objects</term>
<term>Symptomatic activities</term>
<term>Target receptor</term>
<term>Test compound</term>
<term>Test compounds</term>
<term>Test organisms</term>
<term>Topical application</term>
<term>Topological</term>
<term>Torsion angles</term>
<term>Total concentration</term>
<term>Toxicity</term>
<term>Toxicity values</term>
<term>Trapidil derivatives</term>
<term>Various properties</term>
<term>Various substituents</term>
<term>Wads volume</term>
<term>Water solubility</term>
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