دانلود مقالات ISI درباره داکت + ترجمه فارسی

Structure-based optimization of morpholino-triazines as PI3K and mTOR inhibitors

Keywords: داکت; Structure-based design; Mammalian target of rapamycin; Phosphatidylinositol 3-kinase; Selectivity; Docking;

دانلود رایگان متن کامل مقاله ISI 5 صفحه سال انتشار : 2012 سفارش ترجمه

Biological evaluation and docking studies of recently identified inhibitors of phosphoinositide-3-kinases

Keywords: داکت; PI3Ks; phosphatidylinositol 3-kinases; PIP3; phosphatidylinositol 3,4,5-triphosphate; QPLD; Quantum-Polarized Ligand Docking; PI3K; Docking; Pharmacophore modeling; Apoptosis; LY294002; GSK2126458;

دانلود رایگان متن کامل مقاله ISI 5 صفحه سال انتشار : 2012 سفارش ترجمه

Structure–activity relationships for the interaction of 5,10-dihydroindeno[1,2-b]indole derivatives with human and bovine carbonic anhydrase isoforms I, II, III, IV and VI

Keywords: داکت; Carbonic anhydrase; Phenol inhibitor; Sulfonamide inhibitor; Docking; Indole

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Impact of epigallo catechin-3-gallate on acetylcholine-acetylcholine esterase cycle in aged rat brain

Keywords: داکت; Acetylcholine esterase; Epigallo catechin gallate; Neurotransmitter; Aging; Docking; Brain

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Discovery of novel EGFR tyrosine kinase inhibitors by structure-based virtual screening

Keywords: داکت; EGFR; Docking; Inhibitor; Virtual screening; Drug discovery;

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Substituted thiobenzoic acid S-benzyl esters as potential inhibitors of a snake venom phospholipase A2: Synthesis, spectroscopic and computational studies

Keywords: داکت; Thioesters; Phospholipase A2; Docking; Snake venom; DFT calculations; Conformational analysis

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Steroids with inhibitory activity against the prostate cancer cells and chemical diversity of marine alga Tydemania expeditionis

Keywords: داکت; Tydemania expeditionis; Steroid; Prostate cancer; Androgen receptor; Docking

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Molecular modeling and docking characterization of Dectin-1 (PAMP) receptor of Bubalus bubalis

Keywords: داکت; Dectin-1 receptor; β-glucan; Homology modeling; Docking

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Discovery of new non-steroidal FXR ligands via a virtual screening workflow based on Phase shape and induced fit docking

Keywords: داکت; FXR; Phase shape; Docking; Ligands; Virtual screening;

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Preclinical evaluation and molecular docking of 4-phenyl-1-Napthyl phenyl acetamide (4P1NPA) from Streptomyces sp. DPTB16 as a potent antifungal compound

Keywords: داکت; Antifungal resistance; Antifungal; 4P1NPA; In silico pharmacology and docking tools; Docking; CYP51;

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Footprint-based identification of viral entry inhibitors targeting HIVgp41

Keywords: داکت; HIVgp41; Virtual screening; Structure-based drug design; Molecular footprints; Pose rescoring; Docking; DOCK

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Cyclin-dependent kinases 5 template: Useful for virtual screening

Keywords: داکت; Cyclin-dependent kinases 5; Docking; Virtual screening; Active site; Drug design; Cancer; Template

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Engineered enzyme interactions with polycyclic aromatic hydrocarbons: A theoretical approach

Keywords: داکت; PAH; Enzyme; Molecular dynamics; Docking; Bioremediation

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Molecular modeling, synthesis and screening of some new 4-thiazolidinone derivatives with promising selective COX-2 inhibitory activity

Keywords: داکت; Cyclooxygenase enzyme; 4-Thiazolidinone; Docking;

دانلود رایگان متن کامل مقاله ISI 6 صفحه سال انتشار : 2012 سفارش ترجمه

Enrichment of virtual hits by progressive shape-matching and docking

Keywords: داکت; Virtual screening; Lead hopping; Docking; Ligand-centric methods; Receptor-centric methods; Principal component analysis

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

AgNO3 mediated C-N bond forming reaction: synthesis of 3-substituted benzothiazines as potential COX inhibitors

Keywords: داکت; Benzothiazine; Benzenesulfonamides; AgNO3; COX; Docking;

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Vasorelaxant activity of some structurally related triterpenic acids from Phoradendron reichenbachianum (Viscaceae) mainly by NO production: Ex vivo and in silico studies

Keywords: داکت; Docking; eNOS; Hypertension; Pentacyclic acid triterpenoids; Vasorelaxation;

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Inverse Virtual Screening allows the discovery of the biological activity of natural compounds

Keywords: داکت; Inverse Virtual Screening; Docking; Natural compounds;

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

In silico modeling and docking studies of Soap Nut Trypsin Inhibitor

Keywords: داکت; SNTI; MALDI-TOF; Homology modeling; Docking;

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Prediction of inhibitory activities of Hsp90 inhibitors

Keywords: داکت; LHJVNLIKNRRSMN-UHFFFAOYSA-N; KUFRQPKVAWMTJO-DUFJWHHOSA-N; TUOSCZDRWRYPRS-UHFFFAOYSA-N; BWLWUGBHOXIUBP-UHFFFAOYSA-N; JCDXXNIRWRRGBX-UHFFFAOYSA-N; PPFZLLAIQRZNJE-UHFFFAOYSA-N; KCIOVTSUEXGUFJ-UHFFFAOYSA-N; MWHAHELTVGJGFJ-UHFFFAOYSA-N; PASRTKOWXJDFFV-UHFFFAOY

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Discovery of novel sulfonamides as potent and selective inhibitors against human and mouse 11β-hydroxysteroid dehydrogenase type 1

Keywords: داکت; 11β-HSD1; Inhibitor; Sulfonamide; Diabetes; Docking

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

A novel aminopeptidase N inhibitor developed by virtual screening approach

Keywords: داکت; Aminopeptidase N inhibitors; Virtual screening; Docking; Antitumor; Cell invasion;

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis of novel benzofurocoumarin analogues and their anti-proliferative effect on human cancer cell lines

Keywords: داکت; Benzofurocoumarins; Benzopsoralen analogues; Antitumor activity; Docking; Computational studies

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis, anti-inflammatory activity and molecular docking studies of 2,5-diarylfuran amino acid derivatives

Keywords: داکت; 2,5-Diarylfuran; Suzuki-Miyaura; Amino acids; COX-1 and COX-2; Docking

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Hit to lead evaluation of 1,2,3-triazolo[4,5-b]pyridines as PIM kinase inhibitors

Keywords: داکت; PIM inhibitors; Scaffold hopping; Triazolopyridine; Hit to lead; Phosphorylation of BAD; FLT-3; Crystal structure; Docking; hERG Binding; Mechanism of action

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis and biological activity of novel bifunctional isoxazolidinyl polycyclic aromatic hydrocarbons

Keywords: داکت; DNA; Cation recognition; Cycloaddition; Docking; Anticancer agents

دانلود رایگان متن کامل مقاله ISI 7 صفحه سال انتشار : 2012 سفارش ترجمه

Conformationally restricted novel pyrazole derivatives: Synthesis of 1,8-disubstituted 5,5-dimethyl-4,5-dihydro-1H-benzo[g]indazoles as a new class of PDE4 inhibitors

Keywords: داکت; Pyrazole; Benzo[g]indazole; PDE4; X-ray; Docking;

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Explication of interactions between HMGCR isoform 2 and various statins through In silico modeling and docking

Keywords: داکت; Statins; Docking; Homology modeling; HMGCR isoform 1; HMGCR isoform 2;

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Discovery of novel α7 nicotinic acetylcholine receptor ligands via pharmacophoric and docking studies of benzylidene anabaseine analogs

Keywords: داکت; ACHBP; acetylcholine-binding protein; DMXBA; 3-(2,4-dimethoxybenzilidene)-anabaseine; HBD; hydrogen-bond donor; nAChR; nicotinic acetylcholine receptor; Pdb; protein databank; rmsd; root-mean-squared-deviation; ROC; receiver operating characteristic curve

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Study on the interaction of glycyrrhizin and glycyrrhetinic acid with RNA

Keywords: داکت; RNA; Glycyrrhizin; Glycyrrhetinic acid; FTIR; UV–Visible spectroscopy; Docking

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Fragment-based discovery of hydroxy-indazole-carboxamides as novel small molecule inhibitors of Hsp90

Keywords: داکت; Hsp90; Heat shock protein 90; Anti-cancer drug; Fragments; Indazoles; Docking; X-ray structure;

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Comparative structural modeling of a monothiol GRX from chickpea: Insight in iron-sulfur cluster assembly

Keywords: داکت; Chickpea; GRX; Monothiol glutaredoxin; Homology modeling; Docking; Iron-sulfur cluster;

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Prediction of heparin binding sites in bone morphogenetic proteins (BMPs)

Keywords: داکت; Heparin; Bone morphogenetic protein (BMP); Growth and differentiation factor (GDF); Transforming growth factor-β (TGF-β); Docking

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Antimalarial evaluation and docking studies of hybrid phenylthiazolyl-1,3,5-triazine derivatives: A novel and potential antifolate lead for Pf-DHFR-TS inhibition

Keywords: داکت; 1,3,5-Triazine; Docking; Antimalarial; Antifolate;

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Fragment based lead discovery of small molecule inhibitors for the EPHA4 receptor tyrosine kinase

Keywords: داکت; EPHA4; EPH receptor; Ephrin; Kinase; Cancer; Inhibition; Fragment; In silico; Pharmacophore; Screening; Docking; Crystallization

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

The effect of crebanine on memory and cognition impairment via the alpha-7 nicotinic acetylcholine receptor

Keywords: داکت; Crebanine; Nicotinic acetylcholine receptor; Alzheimer's disease; Cognitive deficits; Docking; Nicotinic antagonist; Memory; Morris water maze

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Docking, synthesis and pharmacological activity of novel urea-derivatives designed as p38 MAPK inhibitors

Keywords: داکت; p38 MAPK; Docking; Anti-inflammatory; Analgesic; Arthritis;

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

A tellurium-based cathepsin B inhibitor: Molecular structure, modelling, molecular docking and biological evaluation

Keywords: داکت; Tellurium; Cathepsin B; X-ray crystal structure; Molecular modelling; Docking; Structure–activity relationships

دانلود رایگان متن کامل مقاله ISI 8 صفحه سال انتشار : 2012 سفارش ترجمه

Molecular Docking and Prediction of Pharmacokinetic Properties of Dual Mechanism Drugs that Block MAO-B and Adenosine A2A Receptors for the Treatment of Parkinson's Disease

Keywords: داکت; Adenosine A2A antagonist; docking; dual-target-directed drugs; monoamine oxidase B;

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Computational identification of novel histone deacetylase inhibitors by docking based QSAR

Keywords: داکت; HDAC; Anti-cancer; Benzimidazole and imidazole inhibitors; Pharmacophore; 3D–QSAR; Virtual screening; Docking

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Analogue-based design, synthesis and docking of non-steroidal anti-inflammatory agents. Part 2: Methyl sulfanyl/methyl sulfonyl substituted 2,3-diaryl-2,3-dihydro-1H-quinazolin-4-ones

Keywords: داکت; Anti-inflammatory activity; Cyclooxygenase-1; Cyclooxygenase-2; 2,3-Diaryl-2,3-dihydro-1H-quinazolin-4-ones; Pharmacophore; Structure–activity relationship; Docking

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis, evaluation and docking studies on 3-alkoxy-4-methanesulfonamido acetophenone derivatives as non ulcerogenic anti-inflammatory agents

Keywords: داکت; Anti-inflammatory activity; Carrageenan-induced paw edema; Docking; In silico; Field align; 3D similarity

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis, in silico, in vitro, and in vivo investigation of 5-[11C]methoxy-substituted sunitinib, a tyrosine kinase inhibitor of VEGFR-2

Keywords: داکت; Sunitinib®; VEGFR; Docking; Molecular dynamics; MM-GBSA; Carbon-11; Radiolabeling

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

In silico prediction of a disease-associated STIL mutant and its affect on the recruitment of centromere protein J (CENPJ)

Keywords: داکت; STIL protein; Docking; Molecular dynamics simulation; CENPJ protein; STIL; SCL/TAL1 interrupting locus; CENPJ; Centromere protein J; MDS; Molecular dynamics simulation; RMSD; Root-mean-square deviation; Rg; Radius of gyration; SASA; Solvent-accessible sur

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis, biological activity and docking study of imidazol-5-one as novel non-nucleoside HIV-1 reverse transcriptase inhibitors

Keywords: داکت; Reverse transcriptase inhibitors; Docking; NNRTIs; HIV-1;

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis, biological evaluation, and molecular docking studies of benzyl, alkyl and glycosyl [2-(arylamino)-4,4-dimethyl-6-oxo-cyclohex-1-ene]carbodithioates, as potential immunomodulatory and immunosuppressive agents

Keywords: داکت; Carbodithioate; Dimedone; Enamine; Indazolethione; Immunomodulatory; Immunosuppressive; Docking; Glycosyl;

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

The crystal structure of the dimeric colicin M immunity protein displays a 3D domain swap

Keywords: داکت; Colicin M immunity protein; Crystal structure; 3D domain swap; ab initio phasing method; Unusual fold; de novo structure solution; X-ray crystallography; Docking

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Interpretation of honeybees contact toxicity associated to acetylcholinesterase inhibitors

Keywords: داکت; Pesticides; Acetylcholinesterase; Honeybees; QSAR; Docking

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Synthesis and SAR studies of mono O-prenylated coumarins as potent 15-lipoxygenase inhibitors

Keywords: داکت; Docking; HLO-1; 3-Carboxycoumarin; Farnesyl; Geranyl;

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه

Characterization of diadzein-hemoglobin binding using optical spectroscopy and molecular dynamics simulations

Keywords: داکت; Diadzein; Natural drug carrier; Intrinsic fluorescence; Molecular dynamics; Docking;

دانلود رایگان متن کامل مقاله ISI 9 صفحه سال انتشار : 2012 سفارش ترجمه