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کلمات کلیدی: Molecular docking


موارد یافت شده: 25

1 - Influence of fluorine substitution on the molecular structure, vibrational assignment, Cu–O bond strength and biological properties by comparing copper (II) trifluorobenzoylacetonate and benzoylacetonate complexes (چکیده)
2 - Synthesis, molecular docking and dynamics studies of pyridazino[4,5- b ]quinoxalin-1(2 H )-ones as targeting main protease of COVID-19 (چکیده)
3 - Molecular docking of bacteriocin enterocin P peptide with mastitis-causing E. coli antigen in cattle (چکیده)
4 - Identification of a new splice-acceptor mutation in HFM1 and functional analysis through molecular docking in nonobstructive azoospermia (چکیده)
5 - Molecular docking of Enterocin-P peptide with DNA: an in silico study (چکیده)
6 - The investigation of inhibiting horse myostatin with human follistatin by molecular docking method (چکیده)
7 - Application of the LAD-LASSO as a dimensional reduction technique in the ANN-based QSAR study: Discovery of potent inhibitors using molecular docking simulation (چکیده)
8 - Suggestion of active 3-chymotrypsin like protease (3CLPro) inhibitors as potential anti-SARS-CoV-2 agents using predictive QSAR model based on the combination of ALASSO with an ANN model (چکیده)
9 - Kinetic and thermodynamic insights into the interaction of Aβ1–42 with astaxanthin and aggregation behavior of Aβ1–42: Surface plasmon resonance, microscopic, and molecular docking studies (چکیده)
10 - 2-Benzylidenebenzofuran-3(2H)-ones as a New Class of Alkaline Phosphatase Inhibitors: Synthesis, SAR Analysis, Enzyme Inhibitory Kinetics and Computational Studies (چکیده)
11 - LaCl3⋅7H2O as an Effective Catalyst for the Synthesis of α-Aminophosphonates under Solvent-Free Conditions and Docking Simulation of Ligand Bond Complexes of Cyclin-Dependent Kinase 2 (چکیده)
12 - Determination of kinetic and thermodynamic parameters of amyloid-b 1-42 interaction with astaxanthin (چکیده)
13 - Homology Modeling and Molecular Docking of the Leishmania Protein Kinase, E9BJT5, A New Target for Leishmaniasis Therapeutics (چکیده)
14 - Ellagic acid and human cancers: a systems pharmacology and docking study to identify principal hub genes and main mechanisms of action (چکیده)
15 - In silico study of dynamic level interaction between CLF36 peptide and coronavirus surface protein in Bovine coronaviruses (چکیده)
16 - Combination of least absolute shrinkage and selection operator with Bayesian Regularization artificial neural network (LASSO-BR-ANN) for QSAR studies using functional group and molecular docking mixed descriptors (چکیده)
17 - Terpyridine-metal complexes: Effects of different substituents on their physico-chemical properties and DFT studies (چکیده)
18 - Exploring 3-Hydroxyflavone Scaffolds as Mushroom Tyrosinase Inhibitors: Synthesis, X-Ray Crystallography, Antimicrobial, Fluorescence Behaviour, Structure-Activity Relationship and Molecular Modelling Studies (چکیده)
19 - Antioxidant and angiotensin-converting enzyme -ACE- inhibitory activity of thymosin alpha-1 -Thα1- peptide (چکیده)
20 - Molecular modeling and experimental study of a new peptide-based microextraction fiber for preconcentrating morphine in urine samples (چکیده)
21 - The Importance of Recognizing Binding Sites and Introducing Methods for Identification of them (چکیده)
22 - Bioinformatics analysis of upstream regions and protein structure of fungal phytase gene (چکیده)
23 - Biochemical characterization of a novel antioxidant and angiotensin I-converting enzyme inhibitory peptide from Struthio camelus egg white protein hydrolysis (چکیده)
24 - Synthesis, characterization and biological evaluation of novel unsaturated amides (چکیده)
25 - Molecular docking studies on the binding properties of TR-14 peptide to angiotensin converting enzyme (چکیده)