Eugenol and its structural analogs inhibit monoamine oxidase A and exhibit antidepressant-like activity 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
MS2Grouper: Group Assessment and Synthetic Replacement of Duplicate Proteomic Tandem Mass Spectra Fulltext Access 12 Pages 2005
Aminoethyl-substituted indole-3-acetic acids for the preparation of tagged and carrier-linked auxin Fulltext Access 12 Pages 2005
Evaluation of Different Quantitative Approaches for the Determination of Noneasily Ionizable Molecules by Different Atmospheric Pressure Interfaces Used in Liquid Chromatography Tandem Mass Spectrometry: Abamectin as Case of Study Fulltext Access 12 Pages 2005
Tricyclic pyrazoles. Part 2: Synthesis and biological evaluation of novel 4,5-dihydro-1H-benzo[g]indazole-based ligands for cannabinoid receptors Fulltext Access 12 Pages 2005
A topological substructural approach applied to the computational prediction of rodent carcinogenicity Fulltext Access 12 Pages 2005
Blackbody Infrared Radiative Dissociation of Nonspecific Protein-Carbohydrate Complexes Produced by Nanoelectrospray Ionization: The Nature of the Noncovalent Interactions Fulltext Access 12 Pages 2005
Investigation of electrospray ionization and electrostatic focusing devices using a three-dimensional electrospray current density profiler Fulltext Access 12 Pages 2005
Synthesis of long-chain amide analogs of the cannabinoid CB1 receptor antagonist N-(piperidinyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-1H-pyrazole-3-carboxamide (SR141716) with unique binding selectivities and pharmacological activities Fulltext Access 12 Pages 2005
Synthesis of 2-(aminocarbonylmethylthio)-1H-imidazoles as novel Capravirine analogues Fulltext Access 12 Pages 2005
Design, synthesis and evaluation of carbazole derivatives as PPARα/γ dual agonists and antioxidants Fulltext Access 12 Pages 2005
Differences between the structural requirements for ABA 8′-hydroxylase inhibition and for ABA activity Fulltext Access 12 Pages 2005
Synthesis and antibody-binding studies of a series of parasite fuco-oligosaccharides Fulltext Access 12 Pages 2005
Direct Qualitative Analysis of Triacylglycerols by Electrospray Mass Spectrometry Using a Linear Ion Trap Fulltext Access 12 Pages 2005
Fragmentation Pathway for Glutamine Identification: Loss of 73 Da from Dimethylformamidine Glutamine Isobutyl Ester Fulltext Access 12 Pages 2005
Synthesis and biological evaluation of penam sulfones as inhibitors of β-lactamases Fulltext Access 12 Pages 2005
Controlling Gas-Phase Reactions for Efficient Charge Reduction Electrospray Mass Spectrometry of Intact Proteins Fulltext Access 12 Pages 2005
In silico ADME modelling: prediction models for blood–brain barrier permeation using a systematic variable selection method Fulltext Access 12 Pages 2005
Thermochemical Stabilities and Structures of the Cluster Ions OCS+, S2+, H+(OCS), and C2H5+ with OCS Molecules in the Gas Phase Fulltext Access 12 Pages 2005
A novel method of estimation of lipophilicity using distance-based topological indices: dominating role of equalized electronegativity Fulltext Access 12 Pages 2005
General synthesis and biological evaluation of α-1-C-substituted derivatives of fagomine (2-deoxynojirimycin-α-C-glycosides) Fulltext Access 12 Pages 2005
Elucidation of the presence and location of t-Boc protecting groups in amines and dipeptides using on-column H/D exchange HPLC/ESI/MS Fulltext Access 12 Pages 2005
Similarities among receptor pockets and among compounds: Analysis and application to in silico ligand screening Fulltext Access 12 Pages 2005
Direct determination of reaction paths and stationary points on potential of mean force surfaces Fulltext Access 12 Pages 2005
Significance of synthetic nanostructures in dictating cellular response Fulltext Access 12 Pages 2005
Modeling and characterization of a nanoliter drug-delivery MEMS micropump with circular bossed membrane Fulltext Access 12 Pages 2005
Comparative protein modeling of methionine S-adenosyltransferase (MAT) enzyme from Mycobacterium tuberculosis: a potential target for antituberculosis drug discovery Fulltext Access 12 Pages 2005
Cluster analysis and three-dimensional QSAR studies of HIV-1 integrase inhibitors Fulltext Access 12 Pages 2005
Benzo[1,2-c]1,2,5-oxadiazole N-oxide derivatives as potential antitrypanosomal drugs. Part 3: Substituents-clustering methodology in the search for new active compounds Fulltext Access 12 Pages 2005
Synthesis of the four stereoisomers of cyclobutane analogues of phenylalanine in enantiomerically pure form Fulltext Access 12 Pages 2005
New and Automated MSn Approaches for Top-Down Identification of Modified Proteins Fulltext Access 12 Pages 2005
Triketones active against antibiotic-resistant bacteria: Synthesis, structure–activity relationships, and mode of action Fulltext Access 12 Pages 2005
Methyltrioxorhenium catalysed synthesis of highly oxidised aryltetralin lignans with anti-topoisomerase II and apoptogenic activities Fulltext Access 12 Pages 2005
Relationships between structure and high-throughput screening permeability of diverse drugs with artificial membranes: Application to prediction of Caco-2 cell permeability Fulltext Access 12 Pages 2005
Ginkgolides and bilobalide: Their physical, chromatographic and spectroscopic properties Fulltext Access 12 Pages 2005
Synthesis and evaluation of molluscicidal and larvicidal activities of some novel enaminones derived from 4-hydroxyquinolinones: Part IX Fulltext Access 12 Pages 2005
Discovery of non-carbohydrate inhibitors of aminoglycoside-modifying enzymes Fulltext Access 12 Pages 2005
A novel non-stochastic quadratic fingerprints-based approach for the ‘in silico’ discovery of new antitrypanosomal compounds Fulltext Access 12 Pages 2005
New antitubulin derivatives in the combretastatin A4 series: synthesis and biological evaluation Fulltext Access 12 Pages 2005
Highly antiproliferative, low-calcemic, side-chain ketone analogs of the hormone 1α,25-dihydroxyvitamin D3 Fulltext Access 12 Pages 2005
Structure–activity studies of 3′-4′-dichloro-meperidine analogues at dopamine and serotonin transporters Fulltext Access 12 Pages 2005
Stereocontrolled synthesis of anticancer β-lactams via the Staudinger reaction Fulltext Access 12 Pages 2005
Synthesis and antitubercular activities of bis-glycosylated diamino alcohols Fulltext Access 12 Pages 2005
Synthesis and biological evaluation of lipophilic Ca1a2L analogues as potential bisubstrate inhibitors of protein:geranylgeranyl transferase-1 Fulltext Access 13 Pages 2005
Synthesis of fully protected α-l-fucopyranosyl-(1â2)-β-d-galactopyranosides with a single free hydroxy group at position 2â², 3â² or 4â² using O-(2-naphthyl)methyl (NAP) ether as a temporary protecting group Fulltext Access 13 Pages 2005
Synthesis and receptor assay of aromatic-ethynyl-aromatic derivatives with potent mGluR5 antagonist activity Fulltext Access 13 Pages 2005
Exploring the active site of phenylethanolamine N-methyltransferase: 3-alkyl-7-substituted-1,2,3,4-tetrahydroisoquinoline inhibitors Fulltext Access 13 Pages 2005
Part 3: Synthesis and biological evaluation of some analogs of the antitumor agents, 2-{4-[(7-chloro-2-quinoxalinyl)oxy]phenoxy}propionic acid, and 2-{4-[(7-bromo-2-quinolinyl)oxy]phenoxy}propionic acid Fulltext Access 13 Pages 2005
Studies of non-nucleoside HIV-1 reverse transcriptase inhibitors. Part 2: Synthesis and structure-activity relationships of 2-cyano and 2-hydroxy thiazolidenebenzenesulfonamide derivatives 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
Fragmentation of Negative Ions from Carbohydrates: Part 3. Fragmentation of Hybrid and Complex N-Linked Glycans 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
Synthesis, structure-activity relationship, and p210bcr-abl protein tyrosine kinase activity of novel AG 957 analogs Fulltext Access 13 Pages 2005
Threshold dissociation and molecular modeling of transition metal complexes of flavonoids Fulltext Access 13 Pages 2005
Synthesis and biological activity of sulphostin analogues, novel dipeptidyl peptidase IV inhibitors Fulltext Access 13 Pages 2005
Asymmetric transesterification of secondary alcohols catalyzed by feruloyl esterase from Humicola insolens Fulltext Access 13 Pages 2005
Applying asymmetric dihydroxylation to the synthesis of difluorinated carbohydrate analogues: a 1,1-difluoro-1-deoxy-d-xylulose Fulltext Access 13 Pages 2005
Bisubstrate analog probes for the insulin receptor protein tyrosine kinase: Molecular yardsticks for analyzing catalytic mechanism and inhibitor design Fulltext Access 13 Pages 2005
Yellow pigments used in rapid identification of aflatoxin-producing Aspergillus strains are anthraquinones associated with the aflatoxin biosynthetic pathway Fulltext Access 13 Pages 2005
Oxidative cascades: A facile biosynthetic strategy for the assembly of complex molecules Fulltext Access 13 Pages 2005
The synthesis and evaluation of 10- and 12-membered ring benzofused enediyne amino acids Fulltext Access 13 Pages 2005
Protonated structures of naturally occurring deoxyribonucleic acids and their interaction with berberine Fulltext Access 13 Pages 2005
Stereochemical determination and bioactivity assessment of (S)-(+)-curcuphenol dimers isolated from the marine sponge Didiscus aceratus and synthesized through laccase biocatalysis Fulltext Access 13 Pages 2005
Antimycobacterial activity of new 3-substituted 5-(pyridin-4-yl)-3H-1,3,4-oxadiazol-2-one and 2-thione derivatives. Preliminary molecular modeling investigations Fulltext Access 13 Pages 2005
Design and synthesis of complementing ligands for mutant thyroid hormone receptor TRβ(R320H): a tailor-made approach toward the treatment of resistance to thyroid hormone Fulltext Access 13 Pages 2005
4-Alkyliden-β-lactams conjugated to polyphenols: Synthesis and inhibitory activity Fulltext Access 13 Pages 2005
Inhibition of the severe acute respiratory syndrome 3CL protease by peptidomimetic α,β-unsaturated esters Fulltext Access 13 Pages 2005
DFT-based ranking of zinc-binding groups in histone deacetylase inhibitors Fulltext Access 13 Pages 2005
Core-modified porphyrins. Part 5: Electronic effects on photophysical and biological properties in vitro Fulltext Access 13 Pages 2005
Design and synthesis of subtype-selective cyclooxygenase (COX) inhibitors derived from thalidomide Fulltext Access 13 Pages 2005
Indolyl esters and amides related to indomethacin are selective COX-2 inhibitors Fulltext Access 13 Pages 2005
Esters and amides of 2,3-dimethoxy-8,9-methylenedioxy-benzo[i]phenanthridine-12-carboxylic acid: Potent cytotoxic and topoisomerase I-targeting agents Fulltext Access 13 Pages 2005
Nitroarylmethylcarbamate prodrugs of doxorubicin for use with nitroreductase gene-directed enzyme prodrug therapy Fulltext Access 13 Pages 2005
A-ring hydroxymethyl 19-nor analogs of the natural hormone 1α,25-dihydroxyvitamin D3: synthesis and preliminary biological evaluation Fulltext Access 13 Pages 2005
New 3- and 4-hydroxyfuranones as anti-oxidants and anti-inflammatory agents Fulltext Access 13 Pages 2005
Chiral linker. Part 2: Synthesis and evaluation of a novel, reusable solid-supported open chain chiral auxiliary derived from m-hydrobenzoin for the diastereoselective reduction of α-keto esters Fulltext Access 13 Pages 2005
Steric determinants in diastereocontrol during Baylis–Hillman reaction of sugar-derived aldehydes Fulltext Access 13 Pages 2005
Connecting traditional QSAR and molecular simulations of papain hydrolysis—importance of charge transfer Fulltext Access 13 Pages 2005
Indolizine 1-sulfonates as potent inhibitors of 15-lipoxygenase from soybeans Fulltext Access 13 Pages 2005
Design, synthesis and anti-plasmodial evaluation in vitro of new 4-aminoquinoline isatin derivatives Fulltext Access 13 Pages 2005
QSAR study for a novel series of ortho monosubstituted phenoxy analogues of α1-adrenoceptor antagonist WB4101 Fulltext Access 13 Pages 2005
Design, synthesis and evaluation of 2,4-diaminoquinazolines as inhibitors of trypanosomal and leishmanial dihydrofolate reductase Fulltext Access 13 Pages 2005
Systematic synthesis of galloyl-substituted procyanidin B1 and B2, and their ability of DPPH radical scavenging activity and inhibitory activity of DNA polymerases Fulltext Access 13 Pages 2005
Protein linear indices of the ‘macromolecular pseudograph α-carbon atom adjacency matrix’ in bioinformatics. Part 1: Prediction of protein stability effects of a complete set of alanine substitutions in Arc repressor Fulltext Access 13 Pages 2005
5-Alkyl-2-alkylamino-6-(2,6-difluorophenylalkyl)-3,4-dihydropyrimidin-4(3H)-ones, a new series of potent, broad-spectrum non-nucleoside reverse transcriptase inhibitors belonging to the DABO family Fulltext Access 13 Pages 2005
Oxathiolene oxide synthesis via chelation-controlled addition of organometallic reagents to alkynols followed by addition of sulfur electrophiles and evaluation of oxathiolene oxides as anticarcinogenic enzyme inducers Fulltext Access 13 Pages 2005
Efficient determination of low-frequency normal modes of large protein structures by cluster-NMA Fulltext Access 13 Pages 2005
Analyzing different parameters of steered molecular dynamics for small membrane interacting molecules Fulltext Access 13 Pages 2005
A model for the interaction between plant GAPN and 14-3-3ζ using protein-protein docking calculations, electrostatic potentials and kinetics Fulltext Access 13 Pages 2005
Molecular dynamics simulations for selection of kinetic hydrate inhibitors Fulltext Access 13 Pages 2005