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Guide for Nonequilibrium Molecular Dynamics Simulations of Organic Solvent Transport in Nanopores: The Case of 2D MXene Membranes
JOURNAL OF CHEMICAL THEORY AND COMPUTATION, Kasım 2024, ISSN: 1549-9618
GÜVENSOY MORKOYUN AYSA,VELİOĞLU SADİYE,BAYSAL TUĞBA,ERSOLMAZ ŞERİFE BİRGÜL
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, No. 109130, Ocak 2020, s. 1-9, ISSN: 0022-3697
DEĞİRMENCİ ÜNAL,KIRCA MESUT
Ünal Değirmenci Özgün Makale
Peg Modified Single-Walled Carbon Nanotubes: Molecular Dynamics Simulations And Experimental Approach
The Porous and Powder Materials Symposium and Exhibitions, PPM 2017, 12 Eylül 2017
MERAN MEHDİ PARTOVİ,AKKUŞ PELİN DENİZ,KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE,YAVUZ NİLGÜN,HIZAL GÜRKAN,GÜNER FATMA SENİHA
Fatma Seniha Güner Özet Bildiri
Investigating the Effect of GLU283 Protonation State on the Conformational Heterogeneity of CCR5 by Molecular Dynamics Simulations
Journal of Chemical Information and Modeling, Vol. 64, Ekim 2024, ISSN: 1549-9596
DOĞAN BERNA,DURDAĞI SERDAR
Berna Doğan 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, GÜNER FATMA SENİHA, KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE
Fatma Seniha Güner Özgün Makale
Graphene oxide-based and porous nanocarriers for drug delivery developed with computational and experimental approaches
SURFACES AND INTERFACES, Vol. 76, Ocak 2025, s. 14, ISSN: 2468-0230
SİRKECİOĞLU AHMET,KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE,SUNGUR FETHİYE AYLİN,BATIREL SAİME,GÜNER FATMA SENİHA,GÜNER-YILMAZ Ö. ZEYNEP,KOCAGA BANU,TATLIER MELKON,YILMAZ ANIL,MİAVAGHİ MEHRAN ALİARİ,BAYAZIT MUSTAFA KEMAL,YÜRÜM ALP,ZABARRA MOHAMMED AHMED,HOOSHMAND SARA,YAVUZ NİLGÜN,YAVUZ REHA
Guide for Nonequilibrium Molecular Dynamics Simulations of Organic Solvent Transport in Nanopores: The Case of 2D MXene Membranes
Journal of Chemical Theory and Computation, Vol. 20, No. 21, Kasım 2024, s. 9642-9654, ISSN: 1549-9618
GÜVENSOY MORKOYUN AYSA,BAYSAL TUĞBA,TANTEKİN-ERSOLMAZ S. BİRGUL,VELİOĞLU SADİYE
The Investigation of Adsorption Processes of Dihalogen Molecules onto Pristine Graphene Surface via Molecular Dynamics and Monte Carlo Simulations
2nd Graphene and Related Technologies: from Laboratory to Industry Symposium, 15 Ekim 2015
SÜTAY BERKAY,YURTSEVER MİNE
Computational assessment of thermostability in miRNA:CNT system using molecular dynamics simulations
Biochimica et Biophysica Acta (BBA) - General Subjects, Vol. 1865, Ocak 2021, ISSN: 0304-4165
GÜVENSOY AYSA, KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE
Peg Modified Single-Walled Carbon Nanotubes: Molecular Dynamics Simulations And Experimental Approach
The Porous and Powder Materials Symposium and Exhibitions, PPM 2017, 12 Eylül 2017
MERAN MEHDİ PARTOVİ,AKKUŞ PELİN DENİZ,KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE,YAVUZ NİLGÜN,HIZAL GÜRKAN,GÜNER FATMA SENİHA
Nilgün Yavuz Özet Bildiri
Molecular dynamics simulations can predict the optimum drug loading amount in pectin hydrogels for controlled release
MATERIALS TODAY COMMUNICATIONS, Vol. 31, Şubat 2022, s. 1-11, ISSN: 2352-4928
KOCAAĞA AYŞE BANU,GÜNER FATMA SENİHA,KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE
Ayşe Banu Kocaağa Özgün Makale
Using Molecular Dynamics Simulations to Predict the Optimum Drug Concentration in Pectin Hydrogels with Controlled Release
2021 Global Nanobiotechnology Consortium (GNC) E-Conference, 13 Mart 2021
KOCAAĞA BANU, GÜNER FATMA SENİHA, KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE
Computational assessment of thermostability in miRNA: CNT system using molecular dynamics simulations
BIOCHIMICA ET BIOPHYSICA ACTA-GENERAL SUBJECTS, Şubat 2021, ISSN: 0304-4165
GÜVENSOY MORKOYUN AYSA,KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE
The Investigation of Adsorption Processes of Dihalogen Molecules onto Pristine Graphene Surface via Molecular Dynamics and Monte Carlo Simulations
2nd Graphene and Related Technologies: from Laboratory to Industry symposium, 15 Ekim 2015
SÜTAY BERKAY,YURTSEVER MİNE
Berkay Sütay Özet Bildiri
Peg Modified Single-Walled Carbon Nanotubes: Molecular Dynamics Simulations and Experimental Approach
3rd International Porous and Powder Materials Symposium and Exhibition PPM, 12 Eylül 2017
MERAN MEHDİ PARTOVİ,AKKUS PELİN DENİZ,KÜRKÇÜOĞLU LEVİTAS AYŞE ÖZGE,KARATEPE NILGUN,HIZAL GÜRKAN,GÜNER FATMA SENİHA
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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