ARAMA SONUÇLARI

Toplam 46 adet sonuçtan 20 tanesi görüntülenmektedir.

Tensile characteristics of boron nanotubes by using reactive molecular dynamics simulations

Elsevier BV, Vol. 209, Haziran 2022, ISSN: 0927-0256

ÇALIŞKAN ERDEM, KIRCA MESUT

Mesut Kırca Özgün Makale

A drug repurposing study to target bacterial ribosome decoding center with molecular docking and molecular dynamics simulations

Lisansüstü Eğitim Enstitüsü, İstanbul Teknik Üniversitesi, 2024

BERİL ATEŞ ULUTÜRK

Ayşe Özge Kürkçüoğlu Levitas Tez Yüksek Lisans Tamamlandı

Molecular dynamics simulations on the structure and interfacial interactions of polyethylene-organoclay nanocomposites

Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2011

EROL YILDIRIM

Mine Yurtsever Tez Doktora Tamamlandı

Investigation of the misfolding pathway of different prion variants via molecular dynamics simulations

Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2015

FULYA ECEM KESKİN

Bülent Balta Tez Yüksek Lisans Tamamlandı

Investigation of drug resistance mechanisms for antiandrogen prostate cancer drug enzalutamide using molecular dynamics simulations

Bilişim Enstitüsü, İstanbul Teknik Üniversitesi, 2020

BEHZAD ASLANI AVILAQ

Sefer Baday Tez Yüksek Lisans Tamamlandı

Determining mechanical properties of coated nanoporous Al-Cu structures by using molecular dynamics simulations

Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2013

ESRA İÇER

Ata Muğan Tez Yüksek Lisans Tamamlandı

Molecular dynamics simulations of carbon-aluminum nanocomposites

Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2017

AHMET SEMİH ERTÜRK

Mesut Kırca Tez Yüksek Lisans Tamamlandı

In silico design of novel hERG-neutral sildenafil-like PDE5 inhibitors

JOURNAL OF BIOMOLECULAR STRUCTURE DYNAMICS, Vol. 35, No. 13, 2017, s. 2830-2852, ISSN: 0739-1102

KAYİK GULRU,TÜZÜN NURCAN,DURDAĞI SERDAR

Nurcan Tüzün Özgün Makale PDE5 inhibitorshERG1 channelmolecular dockingvirtual screeningDe Novo designmolecular dynamicsMMGBSA calculationsCYCLIC-NUCLEOTIDE PHOSPHODIESTERASESMOLECULAR-DYNAMICS SIMULATIONSOPEN-INACTIVATED STATESERECTILE DYSFUNCTIONCHANNEL BLOCKPHARMACOPHORE MODELSPOTASSIUM CHANNELSDRUG DEVELOPMENTK CURRENTDISCOVERY

Mechanical enhancement of an aluminum layer by graphene coating

JOURNAL OF MATERIALS RESEARCH, Vol. 33, No. 18, Eylül 2018, s. 2741-2751, ISSN: 0884-2914

ERTURK AHMET SEMİH,KIRCA MESUT,KIRKAYAK LEVENT

Mesut Kırca Özgün Makale amorphizationcarbon-coated aluminumdeformation characteristicsmechanical behaviormolecular dynamicsMOLECULAR-DYNAMICS SIMULATIONSSEMI-POWDER METHODMULTILAYER GRAPHENEMATRIX COMPOSITESNONLOCAL ELASTICITYCHEMICAL-PROPERTIESPOLYMER COMPOSITESTENSILE PROPERTIESTHERMAL-PROPERTIESOXIDE

Nanoporous gold reinforced with carbon based nanomaterials: A molecular dynamics study

COMPOSITES PART B-ENGINEERING, Vol. 151, No. null, Ekim 2018, s. 62-70, ISSN: 1359-8368

GÜLMEZ DENİZ EZGİ,YILDIZ YUNUS ONUR,KIRCA MESUT

Mesut Kırca Özgün Makale Nanoporous metalsGrapheneCarbon nanotubesFullerenesMolecular dynamicsMechanical propertiesOPEN-CELL FOAMSMECHANICAL-PROPERTIESNANOTUBESCOMPOSITESFULLERENETENSILEIRREGULARITYSIMULATIONSCOMPRESSIONBEHAVIOR

Mechanical behavior of a novel carbon-based nanostructured aluminum material

COMPUTATIONAL MATERIALS SCIENCE, Vol. 144, No. null, 2018, s. 193-209, ISSN: 0927-0256

YILDIZ YUNUS ONUR,ERTURK AHMET SEMİH,KIRCA MESUT

Mesut Kırca Özgün Makale AmorphizationCarbon based aluminumDeformation characteristicsMechanical behaviorMolecular dynamicsNanocompositeMOLECULAR-DYNAMICS SIMULATIONSELECTRICAL-CONDUCTIVITYMATRIX COMPOSITESFULLERENE COMPOSITEEPOXY COMPOSITESLAYER GRAPHENENANOTUBESPERFORMANCEAMORPHIZATIONDEFORMATION

Structural properties of indium phosphide nanorods: molecular dynamics simulations

International Journal of Nanotechnology, Vol. 13, Ocak 2016, s. 809, ISSN: 1475-7435

NAYİR NADİRE,TAŞCI EMRE,ERKOÇ ŞAKİR

Nadire Nayir Özgün Makale NanorodMolecular dynamics

Synthesis, molecular docking and molecular dynamics studies of novel tacrine-carbamate derivatives as potent cholinesterase inhibitors

BIOORGANIC CHEMISTRY, Vol. 115, Ekim 2021, ISSN: 0045-2068

ÖZTEN ÖZGE, ZENGİN KURT BELMA, SÖNMEZ FATİH, DOĞAN BERNA, DURDAĞI SERDAR

Berna Doğan Özgün Makale TacrineCarbamateCovalent DockingMD simulationsAlzheimer's diseaseBIOLOGICAL EVALUATIONACETYLCHOLINESTERASE INHIBITORSPHARMACOLOGICAL EVALUATIONACID HYBRIDSDESIGNAGENTSPREDICTIONPROTEINRIVASTIGMINELIGANDS

Integrating Ligand and Target-Driven Based Virtual Screening Approaches With in vitro Human Cell Line Models and Time-Resolved Fluorescence Resonance Energy Transfer Assay to Identify Novel Hit Compounds Against BCL-2

FRONTIERS IN CHEMISTRY, Vol. 8, Nisan 2020, ISSN: 2296-2646

TUTUMLU GURBET,DOĞAN BERNA,AVSAR TİMUCİN,ORHAN MUGE DİDEM,CALİS SEYMA,DURDAGİ SERDAR

Berna Doğan Özgün Makale BCL-2molecular dockingMD simulationsvirtual screeningtext miningin vitro human cell line modelsTR-FRET assaybinary QSAR modelsDOCKING BASED SEMISYNTHESISACID-DERIVATIVESACCURATE DOCKINGPOSE PREDICTIONPROTEINCANCERFAMILYDYNAMICSINHIBITORSDISCOVERY

Hydrogen Storage in Trimetallic Borohydrides: a Crystal Structure Prediction and Ab Initio Molecular Dynamics Simulations Study

American Chemical Society (ACS), Vol. 127, Eylül 2023, ISSN: 1932-7447

DEMİR SAMET, TORKASHVAND MOSTAFA, JOUYBAR SHİRZAD, NİKFARJAM ZAHRA, ZARGARİ FARSHİD, TAFRESHİ SAEEDEH SARABADANİ, TEKİN ADEM

Adem Tekin Özgün Makale

Investigation of mechanical properties of graphene-CNT reinforced nickel metal matrix nanocomposite structure

Türk Doğa ve Fen Dergisi, Vol. 13, Mart 2024, ISSN: 2149-6366

DEĞİRMENCİ ÜNAL

Ünal Değirmenci Özgün Makale Nickel Carbon-based nanomaterials Molecular dynamics simulations Mechanical properties.

Molecular Mechanism of Protein Arginine Deiminase 2: A Study Involving Multiple Microsecond Long Molecular Dynamics Simulations

BIOCHEMISTRY, Ocak 2022, s. 12, ISSN: 0006-2960

ÇİÇEK ERDEM, MONARD GERALD, SUNGUR FETHİYE AYLİN

Fethiye Aylin Sungur Özgün Makale Moleküler Modelleme

Molecular dynamics simulations can predict the optimum drug loading amount in pectin hydrogels for controlled release

Materials Today Communications, Vol. 31, Haziran 2022, ISSN: 2352-4928

KOCAAGA BANU, GÜNER FATMA SENİHA, KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE

Ayşe Özge Kürkçüoğlu Levitas Özgün Makale

Exploring the binding capacity of lactic acid bacteria derived bacteriocins against RBD of SARS-CoV-2 Omicron variant by molecular simulations

Journal of Biomolecular Structure and Dynamics, Vol. 41, No. 20, Ocak 2023, s. 10774-10784, ISSN: 0739-1102

EROL ISMAİL, KOTİL ENES SEYFULLAH, ORTAKCI FATİH, DURDAĞI SERDAR

Fatih Ortakcı Özgün Makale

Molecular dynamics simulations can predict the optimum drug loading amount in pectin hydrogels for controlled release

Materials Today Communications, Vol. 31, Ocak 2022, ISSN: 2352-4928

KOCAAĞA AYŞE BANU, KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE, GÜNER FATMA SENİHA

Ayşe Banu Kocaağa Özgün Makale

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