دانلود مقالات ISI درباره داکت + ترجمه فارسی

Novel insights into structure–function mechanism and tissue-specific expression profiling of full-length dxr gene from Cymbopogon winterianus

Keywords: داکت; Citronella; DXR; Molecular modelling; Molecular dynamics simulation; Docking

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

Multistage virtual screening and identification of novel HIV-1 protease inhibitors by integrating SVM, shape, pharmacophore and docking methods

Keywords: داکت; HIV-1 protease; Multistage virtual screening; SVM; Shape; Pharmacophore; Docking;

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

Quinoxaline based bio-active mixed ligand transition metal complexes: Synthesis, characterization, electrochemical, antimicrobial, DNA binding, cleavage, antioxidant and molecular docking studies

Keywords: داکت; Electrochemical; XRD; DNA; Antimicrobial; Super oxide; Docking

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

Marine steroids as potential anticancer drug candidates: In silico investigation in search of inhibitors of Bcl-2 and CDK-4/Cyclin D1

Keywords: داکت; Echinoderms; Marine steroids; Anticancer drug candidate; Bcl-2; CDK-4/Cyclin D1; Docking;

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

Exploration of DNA binding mode, chemical nuclease, cytotoxic and apoptotic potentials of diketone based oxovanadium(IV) complexes

Keywords: داکت; Oxovanadium complexes; DNA binding; Oxidative cleavage; Cytotoxicity; Docking;

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

Design, synthesis and docking studies of novel thienopyrimidine derivatives bearing chromone moiety as mTOR/PI3Kα inhibitors

Keywords: داکت; Thienopyrimidine; Chromone; Synthesis; Docking; mTOR; PI3Kα; Cytotoxicity

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

Structure based designing and ADME-T studies of butenolide derivatives as potential agents against receptor ICAM-1: A drug target for cerebral malaria

Keywords: داکت; Cerebral malaria pathogenesis; ICAM-1; Butenolide; Artesunate; Docking; ADME-T

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

Molecular conformational analysis, vibrational spectra, NBO, NLO analysis and molecular docking study of bis[(E)-anthranyl-9-acrylic]anhydride based on density functional theory calculations

Keywords: داکت; DFT; FT-IR; FT-Raman; Anthracene; Docking

دانلود رایگان متن کامل مقاله ISI 10 صفحه سال انتشار : 2015 سفارش ترجمه

In silico prediction of prostaglandin D2 synthase inhibitors from herbal constituents for the treatment of hair loss

Keywords: داکت; Androgenic alopecia; Docking; Hair loss; Prostaglandin D2 synthase; Traditional Chinese medicines

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2015 سفارش ترجمه

Using CubeSat/micro-satellite technology to demonstrate the Autonomous Assembly of a Reconfigurable Space Telescope (AAReST)

Keywords: داکت; CubeSat; Rendezvous; Docking; Telescope; Adaptive optics;

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2015 سفارش ترجمه

New pyridin-3-ylmethyl carbamodithioic esters activate pyruvate kinase M2 and potential anticancer lead compounds

Keywords: داکت; Pyruvate kinase M2; Dithiocarbamic acid ester; Structure-activity relationship; Anti-proliferation; Docking;

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2015 سفارش ترجمه

Ergot alkaloids: From witchcraft till in silico analysis. Multi-receptor analysis of ergotamine metabolites

Keywords: داکت; Ergot alkaloids; Ergotamine metabolites; Serotonin receptors; In silico analysis; Docking

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2015 سفارش ترجمه

Synthesis, structure, protein binding of Cu(II) complexes with a tridentate NNO Schiff-base ligand

Keywords: داکت; Cu complexes; HSA; Spectroscopy; Docking

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2015 سفارش ترجمه

AUV docking experiments based on vision positioning using two cameras

Keywords: داکت; AUV; Docking; Vision based navigation; Tracking control

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2015 سفارش ترجمه

Synthesis, biological investigation and molecular docking study of N-malonyl-1,2-dihydroisoquinoline derivatives as brain specific and shelf-stable MAO inhibitors

Keywords: داکت; MAOIs; 1,2-Dihydroisoquinoline; Brain-specific delivery; Chemical delivery system; Docking

دانلود رایگان متن کامل مقاله ISI 11 صفحه سال انتشار : 2015 سفارش ترجمه

Model structures of inactive and peptide agonist bound C5aR: Insights into agonist binding, selectivity and activation

Keywords: داکت; GPCR modeling; Peptide agonist; Docking; MD simulation; POPC bilayer; Activation mechanism;

دانلود رایگان متن کامل مقاله ISI 12 صفحه سال انتشار : 2015 سفارش ترجمه

Design, synthesis and biological evaluation of a class of bioisosteric oximes of the novel dual peroxisome proliferator-activated receptor α/γ ligand LT175

Keywords: داکت; PPAR; Bioisosterism; Docking; Gene expression studyMS, metabolic syndrome; CVD, cardiovascular disease; FFAs, free fatty acids; LBD, ligand binding domain; MOIMM, [(methyloxy)imino]methyl moiety; 3D-QSAR, three-dimensional quantitative structure activity

دانلود رایگان متن کامل مقاله ISI 12 صفحه سال انتشار : 2015 سفارش ترجمه

Imidacloprid and thiacloprid neonicotinoids bind more favourably to cockroach than to honeybee α6 nicotinic acetylcholine receptor: Insights from computational studies

Keywords: داکت; nAChR; nicotinic acetylcholine receptor; Ac-AChBP; Aplysia californica-acetylcholine binding protein; LGICs; ligand-gated ion channels; GABA; gamma-aminobutyric acid; 5-HT3; 5-hydroxytryptamine receptor subtype 3; CHARMM; Chemistry at Harvard Molecular Me

دانلود رایگان متن کامل مقاله ISI 12 صفحه سال انتشار : 2015 سفارش ترجمه

Computational fishing of new DNA methyltransferase inhibitors from natural products

Keywords: داکت; Anticancer; Screening; QSAR; Docking; Cluster

دانلود رایگان متن کامل مقاله ISI 12 صفحه سال انتشار : 2015 سفارش ترجمه

Macrocyclic naphthalene diimides as G-quadruplex binders

Keywords: داکت; ALT; Alternative Lengthening Mechanisms; NDI; naphthalene diimides; FRET; Fluorescence Resonance Energy Transfer; SRB; sulforhodamine; PTS; Polyamines Transport Systems; PRCG; Polak-Ribiere Conjugate Gradient; AD4; AutoDock 4.2; MD; molecular dynamics;

دانلود رایگان متن کامل مقاله ISI 12 صفحه سال انتشار : 2015 سفارش ترجمه

Synthesis and biological evaluation of benzimidazole-oxindole conjugates as microtubule-targeting agents

Keywords: داکت; Benzimidazoles-oxindoles; Cytotoxic activity; Cell cycle; Tubulin polymerization; Docking;

دانلود رایگان متن کامل مقاله ISI 13 صفحه سال انتشار : 2015 سفارش ترجمه

In silico studies, synthesis and binding evaluation of substituted 2-pyrrolidinones as peptidomimetics of RGD tripeptide sequence

Keywords: داکت; Peptidomimetics; RGD; Integrin; Docking; Synthesis; Binding

دانلود رایگان متن کامل مقاله ISI 13 صفحه سال انتشار : 2015 سفارش ترجمه

Effective virtual screening strategy focusing on the identification of novel Bruton's tyrosine kinase inhibitors

Keywords: داکت; BTK inhibitor; Pharmacophore model; Virtual screening; Docking; Molecular dynamics.

دانلود رایگان متن کامل مقاله ISI 13 صفحه سال انتشار : 2015 سفارش ترجمه

In silico studies and fluorescence binding assays of potential anti-prion compounds reveal an important binding site for prion inhibition from PrPC to PrPSc

Keywords: داکت; CoMFA; CoMSIA; Docking; Virtual screening; Fluorescence quenching

دانلود رایگان متن کامل مقاله ISI 14 صفحه سال انتشار : 2015 سفارش ترجمه

Studying the binding interactions of allosteric agonists and antagonists of the CXCR4 receptor

Keywords: داکت; CXCR4; Allosteric agonists and antagonists; Allosteric binding sites; Docking

دانلود رایگان متن کامل مقاله ISI 14 صفحه سال انتشار : 2015 سفارش ترجمه

Thiosemicarbazones as Aedes aegypti larvicidal

Keywords: داکت; Aedes aegypti; Larvicide; Thiosemicarbazones; Sterol carrier protein-2; QSAR; Docking;

دانلود رایگان متن کامل مقاله ISI 14 صفحه سال انتشار : 2015 سفارش ترجمه

Design, synthesis and biological activities of novel oxazolo[4,5-g]quinazolin-2(1H)-one derivatives as EGFR inhibitors

Keywords: داکت; EGFR inhibitor; Oxazolo[4,5-g]quinazolin-2(1H)-one scaffold; Protein tyrosine kinases (PTK); Docking; SAR;

دانلود رایگان متن کامل مقاله ISI 14 صفحه سال انتشار : 2015 سفارش ترجمه

Synthesis, biological evaluation and 3D-QSAR studies of imidazolidine-2,4-dione derivatives as novel protein tyrosine phosphatase 1B inhibitors

Keywords: داکت; PTP1B; Imidazolidine-2,4-dione; Synthesis; CoMFA/CoMSIA; Docking;

دانلود رایگان متن کامل مقاله ISI 14 صفحه سال انتشار : 2015 سفارش ترجمه

In silico methods for predicting drug-drug interactions with cytochrome P-450s, transporters and beyond

Keywords: داکت; Cheminformatics; Computational; Docking; Machine learning; Modeling; Pharmacophore; Physiologically based pharmacokinetics;

دانلود رایگان متن کامل مقاله ISI 15 صفحه سال انتشار : 2015 سفارش ترجمه

Case-specific performance of MM-PBSA, MM-GBSA, and SIE in virtual screening

Keywords: داکت; Molecular mechanics Poisson-Boltzmann surface area (MM-PBSA); Molecular mechanics generalized Born surface area (MM-GBSA); Solvated interaction energy (SIE); Virtual screening; Molecular dynamics simulation; Progesterone receptor; Aldose reductase 2; Am

دانلود رایگان متن کامل مقاله ISI 16 صفحه سال انتشار : 2015 سفارش ترجمه

Design of inhibitors of thymidylate kinase from Variola virus as new selective drugs against smallpox

Keywords: داکت; Variola virus; Thymidylate kinase; Smallpox; Docking; Molecular dynamics

دانلود رایگان متن کامل مقاله ISI 19 صفحه سال انتشار : 2015 سفارش ترجمه

A bioinformatic approach to check the spatial epitope structure of an immunogenic protein coded by DNA vaccine plasmids

Keywords: داکت; DNA vaccine; Docking; Modeling; Targeting; 3D structure;

دانلود رایگان متن کامل مقاله ISI 28 صفحه سال انتشار : 2015 سفارش ترجمه

Design and synthesis of benzothiazole-6-sulfonamides acting as highly potent inhibitors of carbonic anhydrase isoforms I, II, IX and XII

Keywords: داکت; Carbonic anhydrase; Cytosolic isoforms I and II; Tumor-associated isoforms IX; XII; Benzothiazole-6-sulfonamides; Docking;

دانلود رایگان متن کامل مقاله ISI 30 صفحه سال انتشار : 2015 سفارش ترجمه

PKR-inhibitor binds efficiently with human microtubule affinity-regulating kinase 4

Keywords: داکت; PKR-inhibitor; MAP/microtubule affinity-regulating kinase 4; Docking; Drug target; High affinity ligand; Molecular dynamics simulation;

دانلود رایگان متن کامل مقاله ISI 30 صفحه سال انتشار : 2015 سفارش ترجمه

Molecular modeling and docking study on dopamine D2-like and serotonin 5-HT2A receptors

Keywords: داکت; Dopamine receptor; 5-Hydroxytryptamine receptor; Homology modeling; Molecular dynamics; Docking;

دانلود رایگان متن کامل مقاله ISI 31 صفحه سال انتشار : 2015 سفارش ترجمه

Alkaloid metabolite profiles by GC/MS and acetylcholinesterase inhibitory activities with binding-mode predictions of five Amaryllidaceae plants

Keywords: داکت; Alzheimer disease; Amaryllidaceae; Amaryllidaceae alkaloids; Acetylcholinesterase inhibitors; Docking;

دانلود رایگان متن کامل مقاله ISI 34 صفحه سال انتشار : 2015 سفارش ترجمه

HQSAR and topomer CoMFA for predicting melanocortin-4 receptor binding affinities of trans-4-(4-chlorophenyl) pyrrolidine-3-carboxamides

Keywords: داکت; Melanocortin-4 receptor; Binding affinity; Hologram QSAR; Topomer CoMFA; Docking; Piperazinecyclohexanes;

دانلود رایگان متن کامل مقاله ISI 34 صفحه سال انتشار : 2015 سفارش ترجمه

Synthesis, biological evaluation and docking study of maleimide derivatives bearing benzenesulfonamide as selective COX-2 inhibitors and anti-inflammatory agents

Keywords: داکت; Maleimide; COX-2; Ulcerogenic effects; Docking; Carrageenan paw edema;

دانلود رایگان متن کامل مقاله ISI 35 صفحه سال انتشار : 2015 سفارش ترجمه

Cu (I) catalyzed alkyne-azide 1,3-dipolar cycloaddition (CuAAC): Synthesis of 17α-[1-(substituted phenyl)-1,2,3-triazol-4-yl]-19-nor-testosterone-17β-yl acetates targeting progestational and antipro-liferative activities

Keywords: داکت; Click chemistry; Aza steroids; Progestational activity; Docking; Anticancer activity;

دانلود رایگان متن کامل مقاله ISI 36 صفحه سال انتشار : 2015 سفارش ترجمه

Prediction of cytochrome P450 mediated metabolism

Keywords: داکت; Cytochrome P450; Site of metabolism; Machine learning; Ligand-based models; Structure-based models; Reactivity; Docking; Molecular dynamics;

دانلود رایگان متن کامل مقاله ISI 36 صفحه سال انتشار : 2015 سفارش ترجمه

Taxifolin curbs NF-κB-mediated Wnt/β-catenin signaling via up-regulating Nrf2 pathway in experimental colon carcinogenesis

Keywords: داکت; Colon cancer; DMH; Docking; Nrf2; Taxifolin; Wnt/β-catenin;

دانلود رایگان متن کامل مقاله ISI 42 صفحه سال انتشار : 2015 سفارش ترجمه

Pyrazoloquinazolines: Synthetic strategies and bioactivities

Keywords: داکت; Pyrazoloquinazolines; Synthetic strategies; Biological activities; SAR; QSAR; Docking;

دانلود رایگان متن کامل مقاله ISI 43 صفحه سال انتشار : 2015 سفارش ترجمه

Evaluation of novel Akt1 inhibitors as anticancer agents using virtual co-crystallized pharmacophore generation

Keywords: داکت; Co-crystallized structure; Akt1; Cancer; Pharmacophore; Docking; Roc analysis; MCF10A; Cox-2;

دانلود رایگان متن کامل مقاله ISI 43 صفحه سال انتشار : 2015 سفارش ترجمه

Exploring the isoform selectivity of TGX-221 related pyrido[1,2-a]pyrimidinone-based Class IA PI 3-kinase inhibitors: Synthesis, biological evaluation and molecular modelling

Keywords: داکت; Phosphatidylinositol 3-kinase; PI3K; p110β; Docking; Comparative modelling; TGX-221;

دانلود رایگان متن کامل مقاله ISI 44 صفحه سال انتشار : 2015 سفارش ترجمه

Discovery of potent and selective cytotoxic activity of new quinazoline-ureas against TMZ-resistant glioblastoma multiforme (GBM)

Keywords: داکت; Quinazoline-urea; Glioblastoma multiforme (GBM); Translocator protein 18 kDa (TSPO); Mitochondrial permeability transition pore (mPTP); Docking; Clonogenic assay; Toxicity profile;

دانلود رایگان متن کامل مقاله ISI 51 صفحه سال انتشار : 2015 سفارش ترجمه

Prospective performance evaluation of selected common virtual screening tools. Case study: Cyclooxygenase (COX) 1 and 2

Keywords: داکت; Method comparison; Docking; Pharmacophore modeling; Shape-based modeling; 2D similarity-based search; Cyclooxygenase; A; anion; AA; arachidonic acid; Acc; accuracy; ACE; angiotensin-converting enzyme; Ar; aromatic feature; C; cation; COX; cyclooxygenase;

دانلود رایگان متن کامل مقاله ISI 65 صفحه سال انتشار : 2015 سفارش ترجمه

Synthesis of novel flavone hydrazones: In-vitro evaluation of α-glucosidase inhibition, QSAR analysis and docking studies

Keywords: داکت; Flavone; Hydrazone; α-Glucosidase; 2D-QSAR; Docking;

دانلود رایگان متن کامل مقاله ISI 116 صفحه سال انتشار : 2015 سفارش ترجمه

Virtual screening and biochemical evaluation to identify new inhibitors of mammalian target of rapamycin (mTOR)

Keywords: داکت; Virtual screening; mTOR; Docking; Kinase inhibitor; Anticancer agents;

دانلود رایگان متن کامل مقاله ISI 4 صفحه سال انتشار : 2014 سفارش ترجمه

Synthesis of N-(3-arylprop-2-ynyl)substituted olanzapine derivatives as potential inhibitors of PDE4B

Keywords: داکت; Olanzapine; Alkyne; PDE4; Docking;

دانلود رایگان متن کامل مقاله ISI 5 صفحه سال انتشار : 2014 سفارش ترجمه

Aurones as histone deacetylase inhibitors: Identification of key features

Keywords: داکت; Histone deacetylase; Structure activity relationship; Docking; Aurone;

دانلود رایگان متن کامل مقاله ISI 5 صفحه سال انتشار : 2014 سفارش ترجمه