Prof.Dr. DURAN KARAKAŞ

INDIAN JOURNAL OF CHEMISTRY SECTION A-INORGANIC BIO-INORGANIC PHYSICAL THEORETICAL & ANALYTICAL CHEMISTRY , cilt.52, sa.4, ss.480-485, 2013 (SCI-Expanded)

A new approach to predicting the carbonyl stretching frequencies of Co 2(CO)8 with D3d symmetry

KAYA C., KARAKAŞ D., Üstün E.

Indian Journal of Chemistry - Section A Inorganic, Physical, Theoretical and Analytical Chemistry , cilt.46, sa.9, ss.1388-1392, 2007 (SCI-Expanded)

Force constant calculations for Hg[Co(CO)4]2 from the CO-factored force field

KAYA C., KARAKAŞ D.

Indian Journal of Chemistry - Section A Inorganic, Physical, Theoretical and Analytical Chemistry , cilt.46, sa.1, ss.33-38, 2007 (SCI-Expanded)

A new method for assigning the C-O stretching bands in cis-disubstituted octahedral metal carbonyl complexes

Kaya C., Karakas D.

JOURNAL OF ORGANOMETALLIC CHEMISTRY , cilt.660, sa.1, ss.116-120, 2002 (SCI-Expanded)

Force constant calculations for octahedral complexes of the type M(CO)(5)L, based on the CO-factored force field

Karakas D., Kaya C.

JOURNAL OF ORGANOMETALLIC CHEMISTRY , cilt.640, ss.37-40, 2001 (SCI-Expanded)

Diğer Dergilerde Yayınlanan Makaleler

Investigation of the Effect of Main Components of Wild Thyme on Covid-19 by Computational Methods

KAYA S., ERKAN S., KARAKAŞ D.

CUMHURIYET SCIENCE JOURNAL , cilt.44, 2023 (Hakemli Dergi)

Investigation of Antiviral Activities of Nickel and Copper Complexes with Macrocyclic Ligands against Crimean-Congo Hemorrhagic Fever by In Silico Calculations

ERKAN S., BULUT N., KARAKAŞ D.

CUMHURIYET SCIENCE JOURNAL , cilt.44, 2023 (Hakemli Dergi)

Computational spectroscopic investigation of the effect of nitrosyl bonding type on molecular properties in iron tetracarbonyl nitrosyl complex

Öztarakçı Ö., KARAKAŞ D.

Indian Journal of Chemistry (IJC) , cilt.62, sa.10, ss.1030-1039, 2023 (Scopus)

Investigations of structural, spectral (IR and NMR) and in silico analyses of boron compounds as SERM inhibitor

KAYA S., SAYIN K., ERKAN S., KARAKAŞ D.

Chemical Data Collections , cilt.37, 2022 (Hakemli Dergi)

Computational study on the structural, electronic, molecular and thermochemical properties of hypothetical [Tp(CO)2Mo≡C-Ph)]2+ and [L(CO)2Mo≡C-Ph)]+ carbyne complexes

ZAİM Z., KARAKAŞ D.

Cumhuriyet Science Journal , cilt.42, ss.45-59, 2021 (Hakemli Dergi)

Computational study on molecular structure, vibrational spectrum analysis and acidity strength of P4On (n = 6-10) phosphorus oxides with cage structure

Karakaş D.

Cumhuriyet Science Journal , cilt.41, sa.3, ss.659-664, 2020 (Hakemli Dergi)

Structural, spectroscopic and activity calculations on methanesulfonylhydrazone derivative chromium pentacarbonyl complexes

ERKAN S., SAYIN K., KARAKAŞ D.

Journal of the Turkish Chemical Society, Section A: Chemistry , cilt.5, sa.3, ss.1193-1204, 2018 (Scopus)

Detemination of The Best Method (HF, MP2 and B3LYP) in Calculation of Chemical Hardness

ZAİM Z., ALAGÖZ SAYIN T., SAYIN K., KARAKAŞ D.

Turkish Computational and Theoretical Chemistry , cilt.2, sa.2, ss.7-15, 2018 (Scopus)

Theoretical Investigation of Temperature Effect on the Formation of Sulphuric Acid Rain

SAYIN K., KARAKAŞ D.

Turkish Computational and Theoretical Chemistry , cilt.1, ss.11-16, 2017 (Scopus)

Theoretical investigation on electrophilicity indexes and proton affinities of some boron-nitrogen open-chain species

KARAKAŞ D.

Turkish computational and theoretical chemistry , cilt.1, sa.1, ss.1-10, 2017 (Scopus)

Ab-Initio and DFT Calculations on Some Inorganic InhibitorsComputaional Study on Inorganic Corrosion Inhibitors

SAYIN K., KARAKAŞ D.

Journal of new results in science , cilt.6, sa.1, ss.20-31, 2017 (Hakemli Dergi)

Theoretical Studies on Oxovanadium(IV) Complexes with Sterically Crowded Schiff Base Ligands

KARAKAŞ D., SAYIN K.

Cumhuriyet Science Journal , cilt.38, ss.1-12, 2017 (Hakemli Dergi)

Method and basis set investigations and computational spectral studies for oximato bridged trans platinum II dimer used as anticancer drug

SAYIN K., KARAKAŞ D.

Journal of new results in science , sa.8, ss.1-12, 2015 (Hakemli Dergi)

Method and basis set investigation for trans platinum II oxime complex

SAYIN K., KARAKAŞ D.

Cumhuriyet University Faculty of Science Science Journal (CSJ) , cilt.36, sa.2, ss.1-10, 2015 (Hakemli Dergi)

Theoretical Studies on EightOxovanadium IV Complexes withSalicylaldehyde and Aniline Ligands

ERKAN KARİPER S., SAYIN K., KARAKAŞ D.

Hacettepe Journal of Biology and Chemistry , cilt.42, sa.3, ss.337-342, 2014 (Hakemli Dergi)

Quantum chemical studies on Co ntb pic complex ion

SAYIN K., KARAKAŞ D.

Journal of New Results in Science , cilt.2, ss.54-59, 2013 (Hakemli Dergi)

W(CO)6/CCl4/hv katalizör sistemi ile bazı polimerlerin bozunması

KARAKAŞ D., KAYA C.

C.Ü Fen-Edebiyat Fakültesi, Fen Bilimleri Dergisi , cilt.21, ss.147-153, 1999 (Hakemli Dergi)

[M(CO4)X]2 tipi metal karbonillerin C-O gerilme bantlarının simetri etiketlemesi

Gülcan Ü., KARAKAŞ D., KAYA C.

C.Ü Fen-Edebiyat Fakültesi, Fen Bilimleri Dergisi , cilt.21, ss.177-186, 1999 (Hakemli Dergi)

Hakemli Kongre / Sempozyum Bildiri Kitaplarında Yer Alan Yayınlar

Investigation of Substituent Effect on Rhenium Complexes by DFT Methods: Structural Analysis, IR Spectrum, Quantum Chemical Parameter, NLO and OLED Properties, Molecular Docking

alkaya c., GÜNEY E., nasif v., ERKAN S., KARAKAŞ D.

5 th International Conference on Physical Chemistry & Functional Materials, Sivas, Türkiye, 23 Haziran 2022

Quantum chemical calculations o some platinum-based complexes used as drugs in cancer treatment

Taştan M., Karakaş D.

I. International Cancer Days, Sivas, Türkiye, 19 - 21 Eylül 2019, ss.184 Sürdürülebilir Kalkınma

Computational research on the molecular properties and anti-tumor activity of Pt (II) complexes with a chiral halogenated Schiff base ligand

Kaya S., ERKAN S., KARAKAŞ D.

I. International Cancer Days, 19 - 21 Eylül 2019, ss.455

Computational study on molybdenum-based metal carbonylcomplexes

ERKAN S., KARAKAŞ D.

2nd International Conference on Physical Chemistry and Functional Materials(PCFM’19), 25 - 27 Haziran 2019, ss.1

Quantum Chemical Calculations on Manganese Complexes with Penta-Amine Macrocyclic Schiff Base Ligand: Computational and Molecular Docking Analyses

ERKAN S., SAYIN K., KARAKAŞ D.

2nd International Conference on Physical Chemistry and Functional Materials(PCFM’19), Nevşehir, Türkiye, 25 - 27 Haziran 2019, ss.21

Computational Analysis of Structural, Spectroscopic and NLO Properties on Molybdenum Carbonyl Complexes with 4,4’xx-Dipyridylacetylene Bridge Ligand and Triphenyl Phosphine and Triphenoxy Phosphine Terminal Ligand

ERKAN S., KARAKAŞ D.

2nd International Conference on Physical Chemistry and Functional Materials(PCFM’19), Nevşehir, Türkiye, 25 - 27 Haziran 2019, ss.8

NLO Properties and Molecular Docking Study Molybdenum Carbonyl Complexes with Pyridyl Ligands with Alkyne Unit

ERKAN S., KARAKAŞ D.

2nd International Conference on Physical Chemistry and Functional Materials(PCFM’19), Nevşehir, Türkiye, 25 - 27 Haziran 2019, ss.15

Quantum Chemical Calculations on Ag and Pb Complexes withPenta-Amine Macrocyclic Schiff Base Ligand: Computational andMolecular Docking Analyses

SAYIN K., ERKAN S., KARAKAŞ D.

2nd International Conference on Physical Chemistry and Functional Materials (PCFM’xx19), 25 - 27 Haziran 2019, ss.82

Computational studies on Schrock type Mo(CO)5(Cme2) and Mo(CO)5(Cmeet) alkyliden complexes based on density functional theory

OZCIFCI H., ERKAN KARİPER S., SAYIN K., KARAKAŞ D.

International trace analysis congress, Sivas, Türkiye, 20 - 23 Haziran 2018, ss.136

Investigation of structural, spectral, electronic and biological properties of N-heterocyclic carbene Pd(II) complex

ERKAN KARİPER S., SAYIN K., KARAKAŞ D., TÜZÜN B.

International conference on physical chemistry and functional materials, Elazığ, Türkiye, 19 - 21 Haziran 2018, ss.274

Investigation of 1-allyl-3-butylbenzimidazolium-derived silver (I) complexes in terms of structure and biological activity by computational chemistry methods

SAYIN K., ERKAN KARİPER S., KARAKAŞ D.

International conference on physical chemistry and functional materials, Elazığ, Türkiye, 19 - 21 Haziran 2018, ss.56

Detailed examination of bis-NHC palladium (II) complex by DFT method

ERKAN KARİPER S., SAYIN K., KARAKAŞ D., TÜZÜN B.

International conference on physical chemistry and functional materials, Elazığ, Türkiye, 19 - 21 Haziran 2018, ss.226

Quantum chemical calculations on [Tp(CO)2Mo-C-Ph)]2 and [(L(CO)2Mo-C-Ph)] alkylidine complexes

KARAKAŞ D., ZAİM Z., ERKAN KARİPER S., SAYIN K.

International conference on physical chemistry and functional materials, Elazığ, Türkiye, 19 - 21 Haziran 2018, ss.244

Mer-[Ru(Cl-Ph-tpy)(N-N)(X)] Tipi Rutenyum (II) Komplekslerinin Yapısal, Elektronik ve Antikanser Özelliklerinin Hesaplamalı Kimya Yöntemleriyle Araştırılması

ERKAN KARİPER S., SAYIN K., KARAKAŞ D.

3. Hesaplamalı Kimya Kongresi, Ankara, Türkiye, 12 - 14 Ekim 2017

Investigations of Biological Properties of Some Metal (Mn, Pd and Ag) Complexes with Pentaamine Macrocyclic Schiff Base Ligand: Molecular Docking Calculations

Sayın K., Karakaş D., Erkan Kariper S.

2nd International Gazi Symposium Series, Ankara, Türkiye, 11 - 13 Ekim 2017

Structural, spectroscopic and quantum chemical calculations on cyclometalated iridium (III) complexes with anticancer properties

Erkan Kariper S., Karakaş D.

II. International Gazi Pharma Symposium Series (GPSS 2017), Ankara, Türkiye, 11 Ekim 2017

Investigation of solvent effect on biological reactivity UV VIS and NMR analyses of Zn II complexes with pentaaza macrocyclic Schiff base ligand

Sayın K., Karakaş D., Karakuş N., Erkan Kariper S., Alagoz Sayın T.

II. International Turkish Congress on Molecular Spectroscopy, Antalya, Türkiye, 13 - 18 Eylül 2015

Alkin birimli pridil ligantlarıyla köprülenmiş iki çekirdekli metal karboniller üzerine kuantum kimyasal çalışmalar

KARAKAŞ D., ERKAN KARİPER S., SAYIN K.

Kafkas Üniversitesi, 2. Ulusal Hesaplamalı Kimya Kongresi, Türkiye, 2 - 05 Haziran 2015

Makrosiklik schiff baz ligandlı çinko II kompleksleri üzerine hesaplamalı kimya çalışmaları

SAYIN K., KARAKAŞ D., KARAKUŞ N., ERKAN KARİPER S., ALAGÖZ SAYIN T.

2. ULUSAL HESAPLAMALI KİMYA KONGRESİ, Türkiye, 2 - 05 Haziran 2015

Yoğunluk fonksiyon teori metoduyla MgO2Ti2 OPri 6 MgO2Ti2 OPri 2 Acac 4 ve MgO2Ti2 OPri 2 bzac 4 kompleksleri üzerine hesapsal çalışmalar

Sayın K., Karakaş D., Sultan E. K.

Mersin Üniversitesi, V. Ulusal Anorganik Kimya Kongresi, Türkiye, 22 - 25 Nisan 2015

Bipiridin ve pridil primidin 4 karboksilik asit temelli ligantları içeren Ru II komplekslerinin yapısal ve antitümör özellikleri üzerine teorik çalışma

KARAKAŞ D., SAYIN K., ERKAN KARİPER S.

V. Ulusal Anorganik Kimya Kongresi, Türkiye, 22 - 25 Nisan 2015

Oksimato köprülü trans platin II kompleksi üzerine kuantum kimyasal çalışmalar

SAYIN K., KARAKAŞ D., ERKAN S.

Pamukkale Üniversitesi, IV. Fiziksel Kimya Kongresi, Denizli, Türkiye, 5 - 08 Haziran 2014

Platin II oksim kompleksinin 13C ve 1H NMR spektrumlarının hesaplamalı kimya yöntemleriyle incelenmesi

KARAKAŞ D., SAYIN K., ERKAN KARİPER S.

1. Hesaplamalı Kimya Çalıştayı, Türkiye, 29 - 31 Mayıs 2014

Schiff baz ligantlı oksovanadyum IV komplekslerinin antidiabetik aktivitesi üzerine elektronik yapı etkisinin teorik olarak araştırılması

KARAKAŞ D., ERKAN S., SAYIN K.

Yüzüncü Yıl Üniversitesi, I. Uluslar Arası Katılımlı Ulusal Hesaplamalı Kimya Çalıştayı, Van, Türkiye, 29 - 31 Mayıs 2014

Ab initio moleküler orbital yöntemleri ile Co2(CO)8 izomerlerinin moleküler yapı parametrelerinin ve titreşim frekanslarının hesaplanması

ERKAN S., KARAKAŞ D.

GOP Üniversitesi, IV Ulusal Anorganik Kimya Kongresi, Türkiye, 30 Mayıs - 02 Haziran 2013

Kitap & Kitap Bölümleri

Moleküler Simetri

Karakaş D., Kaya C.

Palme Yayın Dağıtım, Ankara, 2010

Metrikler

Yayın

102

Atıf (WoS)

551

H-İndeks (WoS)

Atıf (Scopus)

630

H-İndeks (Scopus)

Proje

Tez Danışmanlığı

Açık Erişim

BM Sürdürülebilir Kalkınma Amaçları

Yayınlar & Eserler

SCI, SSCI ve AHCI İndekslerine Giren Dergilerde Yayınlanan Makaleler

Diğer Dergilerde Yayınlanan Makaleler

Hakemli Kongre / Sempozyum Bildiri Kitaplarında Yer Alan Yayınlar

Kitap & Kitap Bölümleri

Metrikler

Yayın

Atıf (WoS)

H-İndeks (WoS)

Atıf (Scopus)

H-İndeks (Scopus)

Proje

Tez Danışmanlığı

Açık Erişim