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demoمقالات اسکولار

SMILES-based QSAR virtual screening to identify potential therapeutics for COVID-19 by targeting 3CLpro and RdRp viral proteins

F Bazzi-Allahri, F Shiri, S Ahmadi, AP Toropova, AA Toropov
BMC chemistry 18 (1), 191, 2024 Cited By: -

Identification of new positron emission tomography (PET) imaging agents for the ghrelin receptor in disease through molecular modeling

R Mozafari, F Shiri, P Karimi, M Salahinejad, M Nejati-Yazdinejad
Network Modeling Analysis in Health Informatics and Bioinformatics 13 (1), 40, 2024 Cited By: -

Improving Tamoxifen Performance in Inducing Apoptosis and Hepatoprotection by Loading on a Dual Nanomagnetic Targeting System

Y Zhao, W Ding, P Zhang, L Deng, Y Long, J Lu, F Shiri, M Heidari Majd
Anti-Cancer Agents in Medicinal Chemistry-Anti-Cancer Agents) 24 (13), 1016-1028, 2024 Cited By: -

Alcohol-based deep eutectic solvents with pH-responsive hydrophobicity for the analysis of herbicides in water and fruit juice samples

N Fattahi, P Zohrabi, F Shiri, FHB Sosa, B Hashemi
Separation and Purification Technology 339, 126607, 2024 Cited By: 4

Experimental and Theoretical Approaches to Monitor the Behavior of Bovine Liver Catalase in Interaction with a Binuclear Bismuth Complex

Z Alimoradi, F Shiri, S Shahraki, Z Razmara, M Heidari-Majd
ACS omega 9 (25), 27071-27084, 2024 Cited By: 1

Optimization of Monte Carlo Method-Based QSPR modeling for lipophilicity in radiopharmaceuticals

F Bamdi, F Shiri, S Ahmadi, M Salahinejad, F Bazzi-Allahri
Chemical Physics Letters 843, 141239, 2024 Cited By: -

Hit discovery of potential CDK8 inhibitors and analysis of amino acid mutations for cancer therapy through computer-aided drug discovery

R Aghahasani, F Shiri, H Kamaladiny, F Haddadi, S Pirhadi
BMC chemistry 18 (1), 73, 2024 Cited By: -

Corrigendum to “Increase delivery, cytotoxicity, stability and induction of apoptosis in cisplatin by establishing a new complex with methotrexate”[J. Drug Deliv. Sci. Technol …

F Xu, L Zhang, MH Majd, F Shiri, P Karimi, X Guo
Journal of Drug Delivery Science and Technology 92, 105272, 2024 Cited By: -

Experimental design for removal of lead ions from water samples using an engineered novel chitosan functionalized Schiff-base adsorbent

E Rahmanifar, F Shiri, S Shahraki, P Karimi
Chemical Engineering Communications 210 (11), 2022-2034, 2023 Cited By: 4

QSTR based on Monte Carlo approach using SMILES and graph features for toxicity toward Tetrahymena pyriformis

N Rezaie-keikhaie, F Shiri, S Ahmadi, M Salahinejad
Journal of the Iranian Chemical Society 20 (10), 2609-2620, 2023 Cited By: 4

Increase delivery, cytotoxicity, stability and induction of apoptosis in cisplatin by establishing a new complex with methotrexate

F Xu, L Zhang, MH Majd, F Shiri, P Karimi, X Guo
Journal of Drug Delivery Science and Technology 86, 104683, 2023 Cited By: 2

A study of the interaction space of two lactate dehydrogenase isoforms (LDHA and LDHB) and some of their inhibitors using proteochemometrics modeling

S Damavandi, F Shiri, A Emamjomeh, S Pirhadi, H Beyzaei
BMC chemistry 17 (1), 70, 2023 Cited By: 3

QSAR and molecular docking studies of isatin and indole derivatives as SARS 3CLpro inhibitors

N Soleymani, S Ahmadi, F Shiri, A Almasirad
BMC chemistry 17 (1), 32, 2023 Cited By: 9

pH-responsive deep eutectic solvents applied in the extraction of abamectin and endosulfan from water and fruit juice samples: a comparative study

M Hassanpour, M Shamsipur, N Babajani, F Shiri, B Hashemi, N Fattahi
Microchemical Journal 187, 108391, 2023 Cited By: 17

Catalytic activity of a new Cd (II) complex in the peroxidation of cyclohexane, and the resulting CdO nanoparticles in the removal of Congo red

Z Razmara, P Karimi, S Shahraki, F Shiri, M Necas
Applied Organometallic Chemistry, e7079, 2023 Cited By: 1

Improving enzymatic performance of antioxidant enzyme catalase in combination with [Mn (phen)2Cl.H2O]Cl.tu complex

ZR Somaye Shahraki, Fereshteh Shiri
applied organometallic chemistry, 2023 Cited By: 11

Discovery and design of radiopharmaceuticals by in silico methods

M Salahinejad, DA Winkler, F Shiri
Current Radiopharmaceuticals 15 (4), 271-319, 2022 Cited By: 4

Green solvents and approaches recently applied for extraction of natural bioactive compounds

B Hashemi, F Shiri, F Švec, L Nováková
TrAC Trends in Analytical Chemistry 157, 116732, 2022 Cited By: 46

The role of folic acid in inducing of apoptosis by zinc (II) complex in ovary and cervix cancer cells

C Yu, M Heidari Majd, F Shiri, S Shahraki, P Karimi
Molecular Diversity 26 (3), 1545-1555, 2022 Cited By: 7

The in vitro apoptotic effect of new zinc complex possessing folic acid and phenanthroline on cervix cancer cells

L Yang, M Heidari Majd, F Shiri, S Shahraki, P Karimi
Applied Organometallic Chemistry 36 (2), e6525, 2022 Cited By: 3

A multidisciplinary study for investigating the interaction of an iron complex with bovine liver catalase

M Hashemizadeh, F Shiri, S Shahraki, Z Razmara
Applied Organometallic Chemistry, e6881, 2022 Cited By: 1

Extraction of parabens from personal care products using a pH-responsive hydrophobic deep eutectic solvent: experimental design and COSMO-RS evaluations

N Fattahi, B Hashemi, F Shiri, M Shamsipur, N Babajani
New journal of chemistry 46 (33), 15851-15859, 2022 Cited By: 20

A mechanistic explanation of two novel Zn (II) dithiocarbamate complexes with β-lactoglobulin

F Shiri, S Shahraki, H Frozandeh-Moghadam
Journal of Biomolecular Structure and Dynamics 39 (14), 5117-5128, 2021 Cited By: 1

Palladium and platinum complexes of folic acid as new drug delivery systems for treatment of breast cancer cells

C He, MH Majd, F Shiri, S Shahraki
Journal of Molecular Structure 1229, 129806, 2021 Cited By: 28

An exploratory study on application of various classification models to distinguish switchable-hydrophilicity solvents based on 3D-descriptors

M Shiri, F Shiri
Separation Science and Technology 56 (5), 961-969, 2021 Cited By: -

Predicting stability constants of transition metals; Y3+, La3+, and UO22+ with organic ligands using the 3D-QSPR methodology

F Shiri, M Salahinejad, N Momeni-Mooguei, M Sanchooli
Journal of Receptors and Signal Transduction 41 (1), 59-66, 2021 Cited By: 3

Use of molecular docking as a decision-making tool in drug discovery

A Abdolmaleki, F Shiri, JB Ghasemi
Molecular docking for computer-aided drug design, 229-243, 2021 Cited By: 13

Assessing the in vitro and in silico interactions of two Palladium (II) dithiocarbamate complexes with human serum albumin

F Shiri, S Shahraki, M Bazzi-Alahri
Journal of Molecular Structure 1221, 128809, 2020 Cited By: 4

Hydrothermal synthesis of a paramagnetic alkali supermolecule, its effect on catalase inhibitory by spectroscopic and theoretical investigation

Z Razmara, F Shiri, S Shahraki
Inorganica Chimica Acta 513, 119946, 2020 Cited By: 4

Structural insights into the origin of phosphoinositide 3-kinase inhibition

S Hariri, B Rasti, M Mirpour, G Vaghar-Lahijani, F Attar, F Shiri
Structural Chemistry 31, 1505-1522, 2020 Cited By: 10

A paramagnetic oxalato-bridged binuclear copper (II) complex as an effective catalase inhibitor. Spectroscopic and molecular docking studies

S Shahraki, Z Razmara, F Shiri
Journal of Molecular Structure 1208, 127865, 2020 Cited By: 27

Computer-aided molecular design of (E)-N-Aryl-2-ethene-sulfonamide analogues as microtubule targeted agents in prostate cancer

F Shiri, SM Bakhshayesh, JB Ghasemi
Arabian Journal of Chemistry 12 (8), 2150-2165, 2019 Cited By: 5

Exploring 3D-QSPR models of human skin permeability for a diverse dataset of chemical compounds

S Rezaei, H Behnejad, F Shiri, JB Ghasemi
Journal of Receptors and Signal Transduction 39 (5-6), 442-450, 2019 Cited By: 4

Synthesis, characterization, cytotoxicity and detailed HSA interaction of new zinc (II) complexes containing dithiocarbamate and heterocyclic N-donor ligands

S Shahraki, M Saeidifar, F Shiri, A Heidari
Polycyclic Aromatic Compounds, 2019 Cited By: 15

Anti-cancer study and whey protein complexation of new lanthanum (III) complex with the aim of achieving bioactive anticancer metal-based drugs

S Shahraki, F Shiri, M Heidari Majd, S Dahmardeh
Journal of Biomolecular Structure and Dynamics 37 (8), 2072-2085, 2019 Cited By: 32

Dynamic structure based pharmacophore modeling of the Acetylcholinesterase reveals several potential inhibitors

F Shiri, S Pirhadi, JB Ghasemi
Journal of Biomolecular Structure and Dynamics 37 (7), 1800-1812, 2019 Cited By: 34

A comparative study of the impact of metal complex size on the in vitro biological behavior of hetero di-and poly-nuclear Mn-Co complexes

S Shahraki, F Shiri, Z Razmara, MH Majd
Journal of Molecular Structure 1178, 617-629, 2019 Cited By: 8

Investigating the biological potency of novel lanthanum (III) amino acid complex: MCF-7 breast cancer cell line, BSA and β-LG as targets

S Shahraki, F Shiri, M Heidari Majd, S Dahmardeh
Journal of the Iranian Chemical Society 16, 301-313, 2019 Cited By: 6

Computational multi-target drug design

A Abdolmaleki, F Shiri, JB Ghasemi
Multi-target drug design using chem-bioinformatic approaches, 51-90, 2019 Cited By: 7

Hyaluronan magnetic nanoparticle for mitoxantrone delivery toward CD44-positive cancer cells

A Sargazi, F Shiri, S Keikha, MH Majd
Colloids and Surfaces B: Biointerfaces 171, 150-158, 2018 Cited By: 40

Proposition of a New Role for Cytarabine in Addition to Anti-Cancer Feature: A Theoretical Study

P Karimi, F Shiri
Jordan Journal of Chemistry (JJC) 13 (3), 141-147, 2018 Cited By: -

Mechanistic understanding and binding analysis of a novel Schiff base palladium (II) complex with β-lactoglobulin and human serum albumin

F Shiri, S Shahraki, S Shahriari
Journal of Molecular Liquids 262, 218-229, 2018 Cited By: 15

Synthesis, characterization, in silico ADMET prediction, and protein binding analysis of a novel zinc(II) Schiff-base complex: Application of multi-spectroscopic and …

S Shahraki, F Shiri, M Saeidifar
Journal of Biomolecular Structure and Dynamics 36 (7), 1666-1680, 2018 Cited By: 22

Hyaluronic acid/polyethylene glycol nanoparticles for controlled delivery of mitoxantrone

A Sargazi, N Kamali, F Shiri, M Heidari Majd
Artificial cells, nanomedicine, and biotechnology 46 (3), 500-509, 2018 Cited By: 35

Binding interaction of isoxsuprine hydrochloride and levothyroxine to milk β-lactoglobulin; from the perspective of comparison

S Shahraki, F Shiri
International journal of biological macromolecules 109, 576-588, 2018 Cited By: 16

An explorative study on potent Gram-negative specific LpxC inhibitors: CoMFA, CoMSIA, HQSAR and molecular docking

F Shiri, M Salahinejad, R Dijoor, M Nejati-Yazdinejad
Journal of Receptors and Signal Transduction 38 (2), 151-165, 2018 Cited By: 6

Identification of new potential HIV-1 reverse transcriptase inhibitors by QSAR modeling and structure-based virtual screening

F Shiri, S Pirhadi, A Rahmani
Journal of Receptors and Signal Transduction 38 (1), 37-47, 2018 Cited By: 25

Determination of atorvastatin tablet samples by dispersive liquid-liquid microextraction based on solidification of organic drop and central composite design optimization using …

F Shiri, B HASHEMI, I Fazlipour, YM NEJATI
JOURNAL OF APPLIED RESEARCHES IN CHEMISTRY (JARC) 12 (3), 79-86, 2018 Cited By: 1

3D-QSAR and Molecular Docking Study on Maleimide-Based Glycogen Synthase Kinase 3 (GSK-3) Inhibitors as Stimulators of Steroidogenesis

S Fereshteh, S Alireza
Polycyclic Aromatic Compounds, 1-15, 2018 Cited By: -

Assessment of the interaction procedure between Pt(IV) prodrug [Pt(5,5′-dmbpy)Cl4 and human serum albumin: Combination of spectroscopic and molecular …

S Shahraki, M Saeidifar, F Shiri, A Heidari
Journal of Biomolecular Structure and Dynamics 35 (14), 3098-3106, 2017 Cited By: 32

Comparative study on the anticancer activities and binding properties of a hetero metal binuclear complex [Co (dipic) 2Ni (OH2) 5]· 2H2O (dipic= dipicolinate) with two carrier …

S Shahraki, F Shiri, MH Majd, Z Razmara
Journal of pharmaceutical and biomedical analysis 145, 273-282, 2017 Cited By: 30

Evaluation of in silico ADMET analysis and human serum albumin interactions of a new lanthanum (III) complex by spectroscopic and molecular modeling studies

S Shahraki, F Shiri, M Saeidifar
Inorganica chimica acta 463, 80-87, 2017 Cited By: 24

Central composite design optimization of dispersive liquid–liquid microextraction based on solidification of organic drop for the determination of 5-hydroxymethyl-2-furfural in …

F Shiri, B Hashemi, S Sobhani
Journal of Analytical Chemistry 72, 671-677, 2017 Cited By: 5

Exploring isoxsuprine hydrochloride binding with human serum albumin in the presence of folic acid and ascorbic acid using multispectroscopic and molecular modeling methods

F Shiri, S Shahraki, A Shahriyar, MH Majd
Journal of Photochemistry and Photobiology B: Biology 170, 152-163, 2017 Cited By: 26

In silico approaches to explore structure of new GPR 119 agonists for treatment of type 2 diabetes mellitus

F Shiri, M Teymoori
Medicinal Chemistry Research 26, 947-961, 2017 Cited By: 10

Synthesis, characterization, protein interaction and antibacterial activity of a lanthanum (iii) complex [La (Trp) 3 (OH 2) 2](Trp= tryptophan) as a new precursor for synthesis …

S Shahraki, F Shiri, H Beyzaei, F Khosravi
New Journal of Chemistry 41 (16), 8413-8421, 2017 Cited By: 15

Molecular docking challenges and limitations

JB Ghasemi, A Abdolmaleki, F Shiri
Pharmaceutical sciences: breakthroughs in research and practice, 770-794, 2017 Cited By: 23

Computer-aided molecular design of some indolinone derivatives of PLK4 inhibitors as novel anti-proliferative agents

F Shiri, S Rakhshani-morad, A Samzadeh-kermani, P Karimi
Medicinal Chemistry Research 25, 2643-2665, 2016 Cited By: 8

Biophysical and molecular docking studies of human serum albumin interactions with a potential anticancer Pt (II) complex

S Shahraki, F Shiri, H Mansouri-Torshizi
Biomacromolecular Journal 2 (1), 65-77, 2016 Cited By: 14

Characterization of the interaction between a platinum (II) complex and human serum albumin: spectroscopic analysis and molecular docking

S Shahraki, F Shiri, H Mansouri-Torshizi, J Shahraki
Journal of the Iranian Chemical Society 13, 723-731, 2016 Cited By: 44

Alignment independent 3D-QSAR, quantum calculations and molecular docking of Mer specific tyrosine kinase inhibitors as anticancer drugs

F Shiri, S Pirhadi, JB Ghasemi
Saudi Pharmaceutical Journal 24 (2), 197-212, 2016 Cited By: 13

Synthesis, characterization, in vitro cytotoxicity, in silico ADMET analysis and interaction studies of 5-dithiocarbamato-1, 3, 4-thiadiazole-2-thiol and its zinc (ii) complex …

F Shiri, S Shahraki, S Baneshi, M Nejati-Yazdinejad, MH Majd
Rsc Advances 6 (108), 106516-106526, 2016 Cited By: 24

3D-QSAR and virtual screening studies in identification of new Rho kinase inhibitors with different scaffolds

E Nazarshodeh, F Shiri, JB Ghasemi
Journal of the Iranian Chemical Society 12, 1945-1959, 2015 Cited By: 13

Application of multivariate linear and nonlinear calibration and classification methods in drug design

A Abdolmaleki, J B Ghasemi, F Shiri, S Pirhadi
Combinatorial Chemistry & High Throughput Screening 18 (8), 795-808, 2015 Cited By: 13

Discovery of new potential antimalarial compounds using virtual screening of ZINC database

J B Ghasemi, F Shiri, S Pirhadi, Z Heidari
Combinatorial Chemistry & High Throughput Screening 18 (2), 227-234, 2015 Cited By: 15

Multivariate statistical analysis methods in QSAR

S Pirhadi, F Shiri, JB Ghasemi
Rsc Advances 5 (127), 104635-104665, 2015 Cited By: 86

Pharmacophore elucidation and 3D-QSAR analysis of a new class of highly potent inhibitors of acid ceramidase based on maximum common substructure and field fit alignment methods

S Pirhadi, F Shiri, JB Ghasemi
Journal of the Iranian Chemical Society 11, 1329-1336, 2014 Cited By: 14

Methods and applications of structure based pharmacophores in drug discovery

S Pirhadi, F Shiri, JB Ghasemi
Current topics in medicinal chemistry 13 (9), 1036-1047, 2013 Cited By: 90

Molecular docking and 3D-QSAR studies of falcipain inhibitors using CoMFA, CoMSIA, and Open3DQSAR

JB Ghasemi, F Shiri
Medicinal Chemistry Research, 1-19, 2012 Cited By: 32

SDF2XYZ2SDF: how to exploit TINKER power in cheminformatics projects

P Tosco, T Balle, F Shiri
Journal of molecular modeling 17, 3021-3023, 2011 Cited By: 14

Open3DALIGN: an open-source software aimed at unsupervised ligand alignment

P Tosco, T Balle, F Shiri
Journal of computer-aided molecular design 25, 777-783, 2011 Cited By: 141

2D quantitative structure-property relationship study of mycotoxins by multiple linear regression and support vector machine

R Khosrokhavar, JB Ghasemi, F Shiri
International journal of molecular sciences 11 (9), 3052-3068, 2010 Cited By: 29

Catalytic activity of tungstophosphoric acid supported on carriers of diverse acidity in the synthesis of enaminones

E Rafiee, H Mahdavi, S Eavani, M Joshaghani, F Shiri
Applied Catalysis A: General 352 (1-2), 202-207, 2009 Cited By: 32

Prediction of solubility of nonionic solutes in anionic micelle (SDS) using a QSPR model

J Ghasemi, A Abdolmaleki, S Asadpour, F Shiri
QSAR & Combinatorial Science 27 (3), 338-346, 2008 Cited By: 19

Thermodynamic characterization of the dimerization equilibrium of newly synthesized polymethine cyanine dyes

JB Ghasemi, F Shiri, TG Deligeorgiev, M Kubista
Journal of the Serbian Chemical Society 73 (10), 1011-1019, 2008 Cited By: 2

Effect of Ethanol on the Protolytic Properties of the Vitamins B Group

J Ghasemi, F Shiri
대한화학회지 51 (1), 21-30, 2007 Cited By: -

demoمقاله در مجله

Pharmacophore elucidation and 3D-QSAR analysis of a new class of highly potent inhibitors of acid ceramidase based on maximum common substructure and field fit alignment methods.

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Computer-aided molecular design of (E)-N-Aryl-2-ethene-sulfonamide analogues as microtubule targeted agents in prostate cance

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Discovery of New Potential Antimalarial Compounds Using Virtual Screening of ZINC Database

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

3D-QSAR and virtual screening studies in identification of new Rho kinase inhibitors with different scaffolds

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Synthesis characterization in vitro cytotoxicity in silico ADMET analysis and interaction studies of 5-dithiocarbamato-1 3 4-thiadiazole-2-thiol and its zinc (ii) complex with human serum albumin combined spectroscopy and molecular docking investigations

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Alignment independent 3D-QSAR quantum calculations and molecular docking of Mer specific tyrosine kinase inhibitors as anticancer drugs

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Characterization of the interaction between a platinum (II) complex and human serum albumin spectroscopic analysis and molecular docking

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Biophysical and Molecular Docking Studies of Human Serum Albumin Interactions with a Potential Anticancer Pt (II) Complex

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Computer-aided molecular design of some indolinone derivatives of PLK4 inhibitors as novel anti-proliferative agents

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Exploring isoxsuprine hydrochloride binding with human serum albumin in the presence of folic acid and ascorbic acid using multispectroscopic and molecular modeling methods

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Evaluation of in silico ADMET analysis and human serum albumin interactions of a new lanthanum (III) complex by spectroscopic and molecular modeling studies

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

In silico approaches to explore structure of new GPR 119 agonists for treatment of type 2 diabetes mellitus

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Methods and Applications of Structure Based Pharmacophores in Drug Discovery

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Multivariate statistical analysis methods in QSAR

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Application of Multivariate Linear and Nonlinear Calibration and Classification Methods in Drug Design

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Molecular Docking Challenges and Limitations

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Central Composite Design Optimization of Dispersive Liquid Liquid Microextraction Based on Solidification of Organic Drop for the Determination of 5-hydroxymethyl-2-furfural in Orange Juice Using High-Performance Liquid Chromatography

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Hyaluronic acid/polyethylene glycol nanoparticles for controlled delivery of mitoxantrone

شيري فرشته
عنوان مجله: ACADEMIC MEDICINE

Assessment of the Interaction Procedure Between Pt(IV) Prodrug [Pt(5,5?-dmbpy)Cl4 and Human Serum Albumin. Combination of Spectroscopic and Molecular Modeling Technique

حيدري آمنه ، شهركي سميه ، شيري فرشته ، Maryam Saeidifar
عنوان مجله: JOURNAL OF BIOMOLECULAR STRUCTURE and DYNAMICS

Synthesis characterization protein interaction and antibacterial activity of a lanthanum(III) complex La(Trp)3(OH2)2 (Trp tryptophan) as a new precursor for synthesis of La2O2CO3 nanoparticles

شيري فرشته
عنوان مجله: ACADEMY OF MANAGEMENT JOURNAL

Synthesis characterization in silico ADMET prediction and protein binding analysis of a novel zinc(II) Schiff-base complex Application of multi-spectroscopic and computational techniques

شيري فرشته
عنوان مجله: JOURNAL OF BIOMOLECULAR STRUCTURE and DYNAMICS

Comparative study on the anticancer activities and binding properties of a hetero metal binuclear complex Co(dipic)2Ni(OH2)52H2O (dipic dipicolinate) with two carrier proteins

شيري فرشته
عنوان مجله: JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS

Binding Interaction of Isoxsuprine Hydrochloride and Levothyroxine to Milk -lactoglobulin From the Perspective of Comparison

شيري فرشته
عنوان مجله: INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES

Identification of new potential HIV-1 reverse transcriptase inhibitors by QSAR modeling and structure-based virtual screening

شيري فرشته
عنوان مجله: JOURNAL OF RECEPTORS AND SIGNAL TRANSDUCTION

An explorative study on potent Gram-negative specific LpxC inhibitors CoMFA CoMSIA HQSAR and molecular docking

شيري فرشته
عنوان مجله: JOURNAL OF RECEPTORS AND SIGNAL TRANSDUCTION

Mechanistic understanding and binding analysis of a novel Schiff base palladium (II) complex with -lactoglobulin and human serum albumin

شيري فرشته
عنوان مجله: JOURNAL OF MOLECULAR LIQUIDS

Dynamic structure based pharmacophore modeling of the Acetylcholinesterase reveals several potential inhibitors

شيري فرشته
عنوان مجله: JOURNAL OF BIOMOLECULAR STRUCTURE and DYNAMICS

The role of folic acid in inducing of apoptosis by zinc(II) complex in ovary and cervix cancer cells

كريمي پويا ، يو چوانرونگ ، مصطفي حيدري مجد ، شيري فرشته ، شهركي سميه
عنوان مجله: MOLECULAR DIVERSITY

The in vitro apoptotic effect of new zinc complex possessing folic acid and phenanthroline on cervix cancer cells

كريمي پويا ، يانگ ليون ، حيدري مجد مصطفي ، شيري فرشته ، شهركي سميه
عنوان مجله: APPLIED ORGANOMETALLIC CHEMISTRY

Palladium and platinum complexes of folic acid as new drug delivery systems for treatment of breast cancer cells

شهركي سميه ، Chenyang He ، Mostafa Heidari Majd ، شيري فرشته
عنوان مجله: JOURNAL OF MOLECULAR STRUCTURE

A mechanistic explanation of two novel Zn(II) dithiocarbamate complexes with b-lactoglobulin

شيري فرشته ، شهركي سميه ، فروزنده مقدم حسين
عنوان مجله: JOURNAL OF BIOMOLECULAR STRUCTURE and DYNAMICS

Predicting stability constants of transition metals; Y3+, La3+, and UO2 2+ with organic ligands using the 3D-QSPR methodology

شيري فرشته ، مريم صلاحي نژاد ، مؤمني موگوئي نادر ، سنچولي محمود
عنوان مجله: JOURNAL OF RECEPTORS AND SIGNAL TRANSDUCTION

An exploratory study on application of various classification models to distinguish switchable-hydrophilicity solvents based on 3D-descriptors

شيري فرشته ، Mohammad Shiri
عنوان مجله: SEPARATION SCIENCE AND TECHNOLOGY

Discovery and Design of Radiopharmaceuticals by In Silico Methods

شيري فرشته ، Winkler David A ، SALAHINEJAD MARYAM
عنوان مجله: Current Radiopharmaceuticals

Green solvents and approaches recently applied for extraction of natural bioactive compounds

شيري فرشته ، هاشمي بشاره ، Franti?ek ?vec ، Lucie Nov?kov?
عنوان مجله: TRAC-TRENDS IN ANALYTICAL CHEMISTRY

Extraction of parabens from personal care products using a pH-responsive hydrophobic deep eutectic solvent: experimental design and COSMO-RS evaluations

شيري فرشته ، Nazir Fattahi ، Beshare Hashemi ، Mojtaba Shamsipur ، Nasrin Babajani
عنوان مجله: NEW JOURNAL OF CHEMISTRY

A multidisciplinary study for investigating the interaction of an iron complex with bovine liver catalase

شيري فرشته ، هاشمي زاده سيدمجتبي ، شهركي سميه ، رزم آرا زهره
عنوان مجله: APPLIED ORGANOMETALLIC CHEMISTRY

pH-responsive deep eutectic solvents applied in the extraction of abamectin and endosulfan from water and fruit juice samples: A comparative study

شيري فرشته ، Mohammad Hassanpour ، Mojtaba Shamsipur ، Nasrin Babajani ، Beshare Hashemi ، Nazir Fattahi
عنوان مجله: MICROCHEMICAL JOURNAL

Experimental design for removal of lead ions from water samples using an engineered novel chitosan functionalized Schiff-base adsorbent

شيري فرشته ، رحماني فر عصمت ، شهركي سميه ، كريمي پويا
عنوان مجله: CHEMICAL ENGINEERING COMMUNICATIONS

Hydrothermal synthesis of a paramagnetic alkali supermolecule, its effect on catalase inhibitory by spectroscopic and theoretical investigation

رزم آرا زهره ، شيري فرشته ، شهركي سميه
عنوان مجله: INORGANICA CHIMICA ACTA

Catalytic activity of a new Cd (II) complex in the peroxidation of cyclohexane and the resulting CdO nanoparticles in the removal of Congo red

شيري فرشته ، رزم آرا زهره ، كريمي پويا ، شهركي سميه ، Marek Necas
عنوان مجله: APPLIED ORGANOMETALLIC CHEMISTRY

Improving enzymatic performance of antioxidant enzyme catalase in combination with [Mn (phen) 2 Cl.H 2 O]Cl.tu complex

شيري فرشته ، شهركي سميه ، رزم آرا زهره
عنوان مجله: APPLIED ORGANOMETALLIC CHEMISTRY

QSAR and molecular docking studies of isatin and indole derivatives as SARS 3CLpro inhibitors

شيري فرشته ، Niousha Soleymani ، Shahin Ahmadi ، Ali Almasirad
عنوان مجله: BMC Chemistry

Synthesis, Characterization, Cytotoxicity and Detailed HSA Interaction of New Zinc(II) Complexes Containing Dithiocarbamate and Heterocyclic N-donor Ligands

حيدري آمنه ، شهركي سميه ، Maryam Saeidifar ، شيري فرشته
عنوان مجله: POLYCYCLIC AROMATIC COMPOUNDS

A study of the interaction space of two lactate dehydrogenase isoforms (LDHA and LDHB) and some of their inhibitors using proteochemometrics modeling

امام جمعه عباسعلي ، دماوندي صديقه ، شيري فرشته ، پيرهادي سميه ، بيضائي حميد
عنوان مجله: BMC Chemistry

QSTR based on Monte Carlo approach using SMILES and graph features for toxicity toward Tetrahymena pyriformis

شيري فرشته ، رضائي كيخائي نسرين ، Shahin Ahmadi ، Maryam Salahinejad
عنوان مجله: Journal of the Iranian Chemical Society JICS

Increase delivery, cytotoxicity, stability and induction of apoptosis in cisplatin by establishing a new complex with methotrexate

شيري فرشته ، Fan Xu ، Li Zhang ، Mostafa Heidari Majd ، كريمي پويا ، Xiangyu Guo
عنوان مجله: JOURNAL OF DRUG DELIVERY SCIENCE AND TECHNOLOGY

Alcohol-based deep eutectic solvents with pH-responsive hydrophobicity for the analysis of herbicides in water and fruit juice samples

شيري فرشته ، Beshare Hashemi ، فتاحي نظير ، ظهرابي پروين ، Filipe Hobi Bordon ´ Sosa
عنوان مجله: SEPARATION AND PURIFICATION TECHNOLOGY

Hit discovery of potential CDK8 inhibitors and analysis of amino acid mutations for cancer therapy through computer-aided drug discovery

شيري فرشته ، اقاحسني راضيه ، كمال الديني حسين ، حدادي فاطمه ، Somayeh Pirhadi
عنوان مجله: BMC Chemistry

Optimization of Monte Carlo Method-Based QSPR modeling for lipophilicity in radiopharmaceuticals

شيري فرشته ، بامدي فريبا ، احمدي شهين ، صلاحي نژاد مريم ، بزي اله ري فائزه
عنوان مجله: CHEMICAL PHYSICS LETTERS

demoمقاله در همایش

Application of activity cliffs to virtual screening for identify lactate dehydrogenase inhibitors using machine learning approaches

امام جمعه عباسعلي ، دماوندي صديقه ، شيري فرشته
عنوان همایش: همايش بيوانفورماتيك ايران

demoکتب

demoسایر فعالیت های پژوهشی

روش هاي محاسباتي در طراحي دارو

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چندبعدي در كيوسار

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غربالگري مجازي بر اساس ساختار و ليگاند و مطالعه كيوسار سه بعدي براي شناسايي آگوسيت هاي جديد GPR 119

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سمينار

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الحاق نمودن مولكولي و مطالعات كيوسار سه بعدي كومفا و كوميسا بر روي مهاركننده هاي گليكوژن سنتاز -3 (GSK-3) با پايه مالئيميد

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طراحي آزمايشات

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تعيين 5- هيدركسي متيل فورفورال توسط روش ميكرواستخراج مايع- مايع پخشي در نمونه هاي آبي جفت شده با كروماتوگرافي مايع با كارايي بالا

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برهم كنش كمپلكس جديد روي دي تيو كربامات محلول در آب به عنوان عامل ضد سرطاني با آلبومين سرم انساني: مطالعات اسپكتروسكوپي و الحاق نمودن مولكولي

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كشف چهار چوب هاي شيميايي جديد براي مهاركننده هاي ترانس كريپتاز معكوس غير نوكلئوزيدي با استفاده از غربالگري مجازي

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مدل سازي كيوسار محلي و كلي براي پيش بيني ثابت هاي پايداري كمپلكس هاي برخي يون هاي فلزي با ليگاندهاي آلي

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مطالعه ي اكتشافي بر روي مهاركننده هاي ويژه گرم منفي قوي Lpxc : CoMFA ، CoMSIA ، HQSAR و الحاق نمودن مولكولي

نجاتي يزدي نژاد مسعود ، شيري فرشته
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تركيب روش هاي طيف سنجي و مدل سازي مولكولي براي بررسي اثرات اسيد فوليك و اسيد اسكوربيك بر تمايل ايزوكسوپرين به آلبومين سرم انساني

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استفاده از كمومتريكس در تعيين ثابت پايداري

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تعيين ثابت هاي پايداري كمپلكس هاي تشكيل شده برخي يونهاي فلزي با مشتقات تيازولي جديد با استفاده از روشهاي كمومتريكس

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عنوان

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آنزيم هاي مصنوعي

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كاربرد اثر انگشت ها در طراحي دارو

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اصول روشهاي كيوسار دو بعدي و سه بعدي

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طراحي داروهاي چند هدفه

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تمرين و پژوهش

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تمرين پژوهش

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تمرين پژوهش

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روشهاي طيف سنجي مدل سازي مولكولي و كمومتريكس براي شناسايي تمايل پيوند ميان يك كمپلكس پالاديم شيفت باز جديد و دو پروتئين

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پايان نامه

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سمينار

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سمينار

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پيش بيني محاسباتي آنتالپي تصعيد تركيبات آلي با استفاده از تكنيك مونت كارلو

شيري فرشته ، احمدي شهين
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سمينار

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پايان نامه

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عنوان: بررسي پاسخ كاتالاز به كمپلكس تك هسته اي مس(II) با ليگاندهاي مخلوط و مكانيسم برهمكنش آنها مطالعات سينتيكي، ترموديناميكي و الحاق مولكولي

شهركي سميه ، رزم آرا زهره ، شيري فرشته ، حيدري آمنه
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بررسي كارايي برخي از حلال هاي اتكتيك عميق در اندازه گيري آلايندههاي زيست-محيطي به روش ميكرواستخراج فاز مايع

احمر حميد ، شيري فرشته
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بررسي پاسخ كاتالاز به كمپلكس تك هسته اي مس(II) با ليگاندهاي مخلوط و مكانيسم برهمكنش آنها. مطالعات سينتيكي، ترموديناميكي و الحاق مولكولي

شهركي سميه ، رزم آرا زهره ، شيري فرشته ، حيدري آمنه
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رويكردهاي تجربي ونظري براي نظارت بر رفتار آنزيم كاتالاز كبد گاو در تعامل با يك كمپلكس بيسموت دوهسته اي

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بكارگيري برخي روش هاي كموانفورماتيكس براي يافتن پيش بيني كننده هاي موثر بر ويژگي فيزيكوشيميايي يك دسته از راديوداروها

شيري فرشته ، احمدي شهين ، صلاحي نژاد مريم
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سمينار

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توسعه يك مدل ارتباط كمي ساختار- فعاليت براي ارزيابي سميت زيست محيطي آبي محصولات مراقبت شخصي

شيري فرشته ، احمدي شهين
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تاثير برهم كنش ميان يك پليمر فلزي تري هترومتاليك بر كاتالاز كبد گاو از ديدگاه تجربي و نظري

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سمينار

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سمينار

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روش هاي مدل سازي محاسباتي براي شناسايي مهاركننده¬هاي قوي فسفوئينوزيتيد 3-كيناز گاما (PI3K?) به عنوان عوامل ضد سرطان

شيري فرشته ، احمدي شهين ، كريمي پويا
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مدل¬سازي كيوسار و الحاق نمودن مولكولي براي شناسايي مهاركننده¬هاي3CLpro وRdRp به عنوان درمان‌هاي بالقوه براي COVID-19

شيري فرشته ، احمدي شهين
پايان نامه/ رساله