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Non-peripherally substituted metallophthalocyanines catalyzed diastereoselective carbonyl-ylide reactions: Synthesis and DFT calculations
Tetrahedron, Vol. 80, Ocak 2021, s. 131892, ISSN: 0040-4020
KIŞKAN FÜSUN ŞEYMA, SESALAN BEHİCE ŞEBNEM, TÜZÜN NURCAN, ÖZKILIÇ YILMAZ, ANAÇ OLCAY
Füsun Şeyma Kışkan Özgün Makale
Metal catalyzed cyclization reactions of carbonyl ylides Synthesis and DFT study of mechanisms
Organometallics, Vol. 26, No. 12, Mayıs 2007, s. 2978-2985, ISSN: 0276-7333
ÇELİK MEHMET ALİ,YURTSEVER MİNE,TÜZÜN NURCAN,KIŞKAN FÜSUN ŞEYMA,SEZER ÖZKAN,ANAÇ OLCAY
Füsun Şeyma Kışkan Özgün Makale
A DFT Study on the Mechanism of Cyclopropanation via Cu acac Catalyzed Diazo Ester Decomposition
Organometallics, Vol. 27, No. 18, Eylül 2008, s. 4600-4610, ISSN: 0276-7333
ÖZEN CİHAN,TÜZÜN NURCAN
Nurcan Tüzün Özgün Makale
Efficient Computation of DFT Commuting Matrices by a Closed Form Infinite Order Approximation to the Second Differentiation Matrix
Signal Processing, Vol. 91, No. 3, Mart 2011, s. 582-589
SERBES AHMET,DURAK ATA LÜTFİYE
Lütfiye Durak Ata Özgün Makale
The discrete fractional Fourier transform based on the DFT matrix
Signal Processing, Vol. 91, No. 3, Mart 2011, s. 571-581, ISSN: 01651684
SERBES AHMET,DURAK ATA LÜTFİYE
Lütfiye Durak Ata Özgün Makale
A novel 3-((5-methylpyridin-2-yl)amino)isobenzofuran-1(3H)-one: Molecular structure describe, X-ray diffractions and DFT calculations, antioxidant activity, DNA binding and molecular docking studies
Journal of Molecular Structure, Vol. 1205, Nisan 2020, s. 127585, ISSN: 0022-2860
YILMAZ ZEYNEP TANRIKULU,ODABAŞOĞLU HAKKI YASİN,ŞENEL PELİN,ADIMCILAR VESELİNA,ERDOĞAN TANER,ÖZDEMİR AYŞE,GÖLCÜ AYŞEGÜL,ODABAŞOĞLU MUSTAFA
Veselina Adımcılar Özgün Makale
A computational insight into cyclopropenone activated dehydration reaction of alcohols
JOURNAL OF MOLECULAR GRAPHICS MODELLING, Vol. 77, No. null, Eylül 2017, s. 106-114, ISSN: 1093-3263
TATAROGLU M. M.,SUNGUR FETHİYE AYLİN
Solvent effects on glycine II Water assisted tautomerization
Journal of Computational Chemistry, Vol. 25, No. 5, Nisan 2004, s. 690-703, ISSN: 0192-8651
BALTA BÜLENT, AVİYENTE VİKTORYA
Solvent effects on glycine I A supermolecule modeling of tautomerization via intramolecular proton transfer
Journal of Computational Chemistry, Vol. 24, No. 14, Kasım 2003, s. 1789-1802, ISSN: 0192-8651
BÜLENT BALTA, VİKTORYA AVİYENTE
Structures and reactivity of gaseous glycine and its derivatives
International Journal of Mass Spectrometry, Vol. 201, No. 1-3, Temmuz 2000, s. 69-85, ISSN: 13873806
BALTA BÜLENT, BASMA MARAL, AVİYENTE VİKTORYA, ZHU CHUANBAO, LİFSHİTZB CHAVA
Experimental and DFT Study on Electronic and Optical Properties of Donor-Acceptor Type Copolymers Containing Thiophene (T), Thienothiophene (TT), Dithienothiophene (DTT) and Bithiazole (NBT) Units
” İstanbul International Organic Electronic Symposium, 2 Aralık 2019
SÜTAY BERKAY,YURTSEVER MİNE,CİCİGÜL HAKAN,TİFTİKÇİ ESRA,TOPAL SEBAHAT,ÖZTÜRK TURAN,SEZER ESMA,USTAMEHMETOĞLU BELKIZ
Mine Yurtsever Tam metin bildiri
QUANTUM CLUSTER APPROACH TO DEACETYLATION REACTION MECHANISMOF O­ACETYLPEPTIDOGLYCAN ESTERASE,
11EuCO­TCC (11 European Conference on Theoretical and Computational Chemistry, 4 Eylül 2017
AKSAKAL ZEYNEP,TATAROĞLU MUAMMER MELİN,SUNGUR FETHİYE AYLİN,TÜZÜN NURCAN
A DFT STUDY ON THE MODEL DEACETYLATION REACTION MECHANISM OF O ACETYLPEPTIDOGLYCAN ESTERASE
10th Congress on Electronic Structure: Principles and Applications,, 28 Ocak 2016
AKSAKAL ZEYNEP,DEMİRKİZAK MUAMMER MELİN,TÜZÜN NURCAN,SUNGUR FETHİYE AYLİN
Fethiye Aylin Sungur Özet Bildiri
Challenging the frontiers of superparamagnetism through strain engineering: DFT investigation and co-precipitation synthesis of large aggregated Fe3O4 (magnetite) powder
Elsevier BV, Vol. 968, Aralık 2023, ISSN: 0925-8388
SARAÇOĞLU MERT, MANSOOR MUBASHİR, BAKIRDÖVEN UTKU, ARPALI HANDENUR, GEZİCİ UTKU ORÇUN, TİMUR SERVET İBRAHİM
Servet İbrahim Timur Özgün Makale
Star-Shaped WS2 Monolayers with Twin Grain Boundaries Promoted by Molybdenum Atoms
2021 MRS Fall Meeting and Exhibit, 27 Kasım 2022
ZHANG NA, SANCHEZ DAVİD, NAYİR NADİRE, ZHANG TİANYİ, ZHOU DA, LİU MİNGZU, YU ZHUOHANG, TERRONES MAURİCİO, VAN DUİN ADRİ, WANG KE, Jİ YANZHOU
Voltammetric quantification, spectroscopic, and DFT studies on the binding of the antineoplastic drug Azacitidine with DNA
Journal of Pharmaceutical and Biomedical Analysis, Vol. 237, No. 115746, Ocak 2024, ISSN: 0731-7085
ŞENEL PELİN, AGAR SOYKAN, YURTSEVER MİNE, GÖLCÜ AYŞEGÜL
Mine Yurtsever Özgün Makale
Investigation of supramolecular interaction of quercetin with N,N-dimethylamine-functionalized p-sulfonated calix[4,8]arenes using molecular modeling and their in vitro cytotoxic response towards selected cancer cells
NEW JOURNAL OF CHEMISTRY, Vol. 45, No. 39, Ekim 2021, s. 18443-18452, ISSN: 1144-0546
MEHMET OĞUZ, DOĞAN BERNA, DURDAĞI SERDAR, KARAKURT SERDAR, YILMAZ MUSTAFA
Voltammetric quantification, spectroscopic, and DFT studies on the binding of the antineoplastic drug Azacitidine with DNA
Elsevier BV, Vol. 237, Ocak 2024, ISSN: 0731-7085
ŞENEL PELİN, AGAR SOYKAN, YURTSEVER MİNE, GÖLCÜ AYŞEGÜL
Ayşegül Gölcü Özgün Makale
Determination of Crystal Structure of Colemanite Using Density Functional Theory DFT
6th INTERNATIONAL CONFERENCE ON COMPUTER APPLICATIONS IN THE MINERALS INDUSTRIES, İstanbul/TUVALU, 5 Ekim 2016
ŞENOL ARSLAN DİLEK,DRELİCH JW,ÖZDEMİR ORHAN,ÇELİK MEHMET SABRİ,ODEGARD GM
Orhan Özdemir Tam metin bildiri
Interactions of TMGa and NH3 with defects in graphene: Towards a mechanistic understanding of 2D GaNx formation
8th International Conference on Clean and Green Energy (ICCGE 2019, 13 Şubat 2019
BANSAL ANUSHKA, NAYİR NADİRE, RAJAPBOUR SİAVASH, HUET BENJAMİN, VAN DUİN ADRİ, JOAN REDWİNG

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