Insight into the Mechanochemical Cycle of Cytoplasmic Dynein from Molecular Dynamics simulations
7th International BAU Drug Design Congress, 19 Aralık 2019
GÜR MERT
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Why Protein Conformers in Molecular Dynamics Simulations Differ from Their Crystal Structures: A Thermodynamic Insight
Turkish Journal of Chemistry, 2019
PULLARA F, WENZHİ M, GUR M
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Tensile characteristics of boron nanotubes by using reactive molecular dynamics simulations
Elsevier BV, Vol. 209, Haziran 2022, ISSN: 0927-0256
ÇALIŞKAN ERDEM, KIRCA MESUT
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Molecular dynamics simulations of carbon-aluminum nanocomposites
Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2017
AHMET SEMİH ERTÜRK
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Investigation of drug resistance mechanisms for antiandrogen prostate cancer drug enzalutamide using molecular dynamics simulations
Bilişim Enstitüsü, İstanbul Teknik Üniversitesi, 2020
BEHZAD ASLANI AVILAQ
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Investigation of the misfolding pathway of different prion variants via molecular dynamics simulations
Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2015
FULYA ECEM KESKİN
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INVESTIGATION OF STRUCTURAL DIFFERENCES BETWEEN WILD-TYPE AND MUTANT FORMS OF MutSα BY MOLECULAR DYNAMICS SIMULATIONS
Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2022
CLARA XAZAL BURAN
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Single-molecule force experiments of motor proteins via molecular dynamics simulations
Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2019
MOHAMMADAMIN SALEHI TABRIZI
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Exploring the conformational transition between closed and open states of the sars-CoV-2 spike glycoprotein using molecular dynamics simulations
Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2020
CEREN KILINÇ
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Molecular dynamics simulations on the structure and interfacial interactions of polyethylene-organoclay nanocomposites
Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2011
EROL YILDIRIM
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Determining mechanical properties of coated nanoporous Al-Cu structures by using molecular dynamics simulations
Fen Bilimleri Enstitüsü, İstanbul Teknik Üniversitesi, 2013
ESRA İÇER
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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
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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
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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
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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
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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
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On determining the thermal state of individual atoms in molecular dynamics simulations of nonequilibrium processes in solids
Chemical Physics Letters, Vol. 506, No. 4-6, Nisan 2011, s. 290-297, ISSN: 00092614
FU YAO,KIRCA MESUT,TO ALBERT CHIFU
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Design and analysis of sandwiched fullerene graphene composites using molecular dynamics simulations
Composites Part B: Engineering, Vol. 79, Eylül 2015, s. 513-520, ISSN: 13598368
KIRCA MESUT
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Reverse non-equilibrium molecular dynamics simulations on the thermal conductivity of three-dimensional graphene nano-ribbon foams
JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, Vol. 136, Ocak 2020, s. 1-9, ISSN: 0022-3697
DEĞİRMENCİ ÜNAL, KIRCA MESUT
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Structural investigation of vesnarinone at the pore domains of open and open-inactivated states of hERG1 K channel
JOURNAL OF MOLECULAR GRAPHICS MODELLING, Vol. 77, No. null, 2017, s. 399-412, ISSN: 1093-3263
KAYİK GULRU,TÜZÜN NURCAN,DURDAĞI SERDAR
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