Pyrene-functionalized Carbon Nanotubes as Emerging Nanocarriers: Insight FromExperimental and Molecular Dynamic Simulation
International Eurasian Conference onBiological and Chemical Sciences(EurasianBioChem 2018), 26 Nisan 2018
MERAN MEHDİ,BAYSAK ELİF,KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE,HIZAL GÜRKAN,YAVUZ NİLGÜN,GÜNER FATMA SENİHA
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Determination of effect of hydrogen on strength of aluminum by MD simulation
APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING, Vol. 128, No. 9, Ocak 2022, ISSN: 0947-8396
TIĞLI AHMET, DIŞPINAR DERYA, DİZDAR KEREM CAN, ŞAHİN HAYATİ
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Removal of oxytetracycline by graphene oxide and Boron-doped reduced graphene oxide: A combined density function Theory, molecular dynamics simulation and experimental study
FLATCHEM, Vol. 27, Ocak 2021, ISSN: 2452-2627
EL HADKİ AHMED, ALTUNTAŞ KÜBRA, EL HADKİ HAMZA, ÜSTÜNDAĞ CEM BÜLENT, KABBAJ OUM KETUM, DACHOUR ABDELMALEK, ZRİNEH ABDALLAH, DEBİK EYÜP
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Oxidation and hydrogenation of monolayer MoS2 with compositing agent under environmental exposure: The ReaxFF Mo/Ti/Au/O/S/H force field development and applications
Frontiers Media SA, Vol. 4, Ekim 2022, ISSN: 2673-3013
MAO QİAN, ZHANG YUWEİ, NAYİR NADİRE, KOWALİK MALGORZATA, VAN DUİN ADRİ, CHANDROSS MİCHAEL
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Molecular dynamics simulation of size, temperature, heating and cooling rates on structural formation of Ag-Cu-Ni ternary nanoparticles (Ag34-Cu33-Ni33)
COMPUTATIONAL MATERIALS SCIENCE, Vol. 183, Ekim 2020, s. 109842, ISSN: 0927-0256
SAFALTIN ŞERZAT,GÜRMEN SEBAHATTİN
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Influence of hydrogen bond on the mesomorphic behaviour in urethane based liquid crystalline compounds: Experimental and computer simulation study
JOURNAL OF MOLECULAR LIQUIDS, Vol. 317, Ağustos 2020, s. 114001, ISSN: 0167-7322
KORKMAZ BURAK, AGTAS SİNEM, SUTAY BERKAY, YILDIRIM EROL, YILGÖR İSKENDER, YURTSEVER MİNE, ŞENKAL BAHİRE FİLİZ, GÜRSEL YEŞİM
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Contact angle of montmorillonite basal surface as determined by experimental and molecular dynamics simulation
Balkan Mineral Processing Congress, 31 Ekim 2017
KARATAŞ DENİZ,HOJİYEV RUSTAM,ÇELİK MEHMET SABRİ
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Molecular Dynamics Simulation Studies on Homodimeric and Monomeric MAO-A and MAO-B Isomers in Different Media: Understanding of Lİgand Binding and Enzyme Selectivity
1st International Balkan Chemistry Congress, Edirne/TÜRKİYE, 17 Eylül 2018
İŞ YUSUF SERHAT,DURDAĞI SERDAR,YURTSEVER MİNE
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Molecular transport and flow past hard and soft surfaces computer simulation of model systems
Journal of Physics: Condensed Matter, Vol. 23, No. 18, Mayıs 2011, s. 184105, ISSN: 0953-8984
LEONFORTE FABİEN,SERVANTİE CEM ÖZGÜR,PASTORİNO CLAUDİO,MARCUS MULLER
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The anisotropic characteristics of natural fibrous sepiolite as revealed by contact angle surface free energy AFM and molecular dynamics simulation
Colloids and Surfaces A: Physicochemical and Engineering Aspects, Vol. 408, No. 408, Ağustos 2012, s. 22-31, ISSN: 09277757
BENLİ BİRGÜL,DU HAO,ÇELİK MEHMET SABRİ
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Compression and shear behavior of ultrathin coated nanoporous gold: A molecular dynamics study
JOURNAL OF APPLIED PHYSICS, Vol. 124, No. 18, Kasım 2018, ISSN: 0021-8979
YILDIZ YUNUS ONUR,KIRCA MESUT
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Mechanical properties of SWNT X Junctions through molecular dynamics simulation
International Journal of Smart and Nano Materials, Vol. 3, No. 1, Mart 2012, s. 33-46, ISSN: 1947-5411
STORMER B A,PIPER N M,YANG X M,TAO J,FU YAO,KIRCA MESUT,TO ALBERT C
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Synthesis, characterization, and molecular simulation of 6FDA/BTDA-pBAPS copolyimide membrane for CO2/CH4 separation
EUROMEMBRANE 2009 Conference,, Montpellier/FRANSA, 6 Eylül 2009
HALİTOĞLU SADİYE,YILMAZ ÖZGE,ORAL ÇİĞDEM,AHUNBAY MEHMET GÖKTUĞ,ERSOLMAZ ŞERİFE BİRGÜL
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Influence of hydrogen bond on the mesomorphic behaviour in urethane based liquid crystalline compounds: Experimental and computer simulation study
JOURNAL OF MOLECULAR LIQUIDS, Vol. 317, Ağustos 2020, s. 114001, ISSN: 0167-7322
KORKMAZ BURAK, AGTAS SİNEM, SUTAY BERKAY, YILDIRIM EROL, YILGÖR İSKENDER, YURTSEVER MİNE, ŞENKAL BAHİRE FİLİZ, GÜRSEL YEŞİM
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The computational study on the elucidation of the binding interactions and mechanism of anti-neoplastic purine derivative drugs with DNA: Molecular docking and md simulation studies
Lisansüstü Eğitim Enstitüsü, İstanbul Teknik Üniversitesi, 2022
SOYKAN AĞAR
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