Forthcoming

Volume: 9 Issue: 3

Year: 2025

Research Article

Research Article

1. DESIGN AND DISCOVERY OF LOPHINE DERIVATIVES AS MULTI-TARGETING AGENTS BY MOLECULAR DOCKING, ADMET, MD SIMULATION AND PHARMACOPHORE ANALYSIS: A COMPUTATIONAL APPROACH

Pujan Sasmal , Shyamal Kumar Biswas , Akash Koley , Rimpa Jana , Jagrity Biswas

Page : 1-24

Research Article

2. CRISPR-Cas Single-Guide RNA Construction for Tail Fiber Gene Gp0047 of Salmonella Phage SSE-121

Erlia Narulita , Annisyah Nurmitha Oktarina , Rina B. Opulencia , Agung Haris Widianto , Riska Ayu Febrianti , Hardian Susilo Addy

Page : 25-37

Research Article

3. Study of the structure of atomics by the method of electron scattering in the distorted-wave approximation: Atomic energy

M.m. Mirteimour , Mina Aliyeva

Page : 38-44

Research Article

4. Virtual screening, Molecular Docking, Molecular Dynamic and ADME of new pyrazole derivatives as anticancer

Ameer Alamiri , Basma M Abd Razik , Noor Aldabagh

Page : 45-56

Research Article

5. Theoretical investigations, Molecular Docking, ADMET analysis, Molecular Dynamic Simulation, and Drug-Likeness Scoring of (E)-1-[2-(3,4-Dimethylphenyl) Diazen-2-Ium-1-Yl] Naphthalen-2-Olate as a Corticosteroid Side-Chain-Isomerase Inhibitor

Youcef Megrouss , Souheyla Chetioui , Chafika Farah Kaouche , Yahıaouı Salem , Khaled Drim , Zohra Douaa Benyahlou , Mansour Azayez , Sid Ahmed Kaas , Mokhtaria Drıssı , Abdelkader Chouaih

Page : 57-78

Research Article

6. Investigation of the FrH+ Alkali Hydride Cation: Analysis of Potential Energies, Dipole Functions, and Radiative Lifetimes

Chedli Ghanmi , Hamid Berriche

Page : 79-88

Research Article

7. Molecular Dynamic Simulation Study of Newly Cytotoxic 2-(Aminomethyl)Benzimidazole Derivatives as Tyrosine Kinase Inhibitors

Suhair Al-sultan , Mohammed Hassan , Wamidh Talib

Page : 89-97

Research Article

8. Computational Evaluation of Molecular Docking and Molecular Dynamic, Study of New Acyloxyalkyl Carbamates Prodrug Derivatives of Fluoxetine

İsraaa Alhariri , Mohammed Dheyaa Hamdi , Ali Rasool Mahmood Albakaa

Page : 98-111

Research Article

9. Electronic and magnetic characteristics of Vanadium doped single-walled silicon carbide nanotubes: DFT study

Sevda Rzayeva , Vusala Jafarova

Page : 112-120

Research Article

10. Investigation of Thermodynamic Properties of Halomethanes Using High-Level Ab Initio Computations: Evaluation of Enthalpy of Formation and Carbon-Halogen Bond Dissociation Energies

Ibrahim Awad

Page : 121-134
Dr. Abdullah KEPCEOĞLU Stanford University 0000-0002-4743-5517
Instrumental Methods, Analytical Spectrometry, Space Instrumentation, Lasers and Quantum Electronics, Nonlinear Optics and Spectroscopy, Atomic and Molecular Physics, Atomic, Molecular and Optical Physics, Physical Sciences, Structural Biology, Nanomaterials, Nanotechnology, Engineering, Mathematical Sciences, Theoretical and Computational Chemistry, Colloid and Surface Chemistry, Photochemistry, Sensor Technology
Prof. Dr. Ayad KAREEM Mustansiriyah University 0000-0002-2353-6444
Pharmaceutical Chemistry, Organic Chemical Synthesis
Debanjan CHATTERJEE
Ehsan AL-MASSOUDY
Prof. Dr. Elvan ÜSTÜN ORDU UNIVERSITY 0000-0002-0587-7261
Chemical Sciences, Inorganic Chemistry, Theoretical and Computational Chemistry
Faris Thanoon ABACHİ
Fouzia BOUCHELAGHEM University Mohamed Boudiaf
Dr. Gamze TÜZÜN CUMHURIYET UNIVERSITY, FACULTY OF SCIENCE
Inorganic Chemistry, Inorganic Green Chemistry, Bioinorganic Chemistry
Ghadeer F. Abu ALSOUD
Prof. Houcine GHALLA Faculty of Sciences of Monastir
Atomic and Molecular Physics
Karima Fadhil ALİ
Prof. Dr. Konstantin P. KATIN Department of Condensed Matter Physics, National Research Nuclear University MEPhI (NRNU MEPhI) 0000-0003-0225-5712
Chemical Sciences, Materials Science and Technologies
Asst. Prof. Lalmohan MAJİ Tarifa Memorial Institute of Pharmacy 0000-0003-1542-7253
Pharmaceutical Analytical Chemistry, Pharmaceutical Biochemistry, Pharmaceutical Chemistry
Prof. Dr. Lotfi BELKHİRİ University of Constantine 1 Frères Mentouri, & Pharmaceutical Sciences Research Center - CRSP ZAM Ali Mendjeli, Constantine, Algeria 0000-0002-6093-6965
Chemical Sciences, Cheminformatics and Quantitative Structure-Activity Relationships
Post Graduate Mehtap ARSLAN BİLECİK ŞEYH EDEBALİ ÜNİVERSİTESİ
Physical Sciences, Mathematical Physics, Particle and High Energy Physics, Nuclear Physics, General Physics, Electrostatics and Electrodynamics, Atomic, Molecular and Optical Physics
Monther FAİSAL
Assoc. Prof. Dr. Necmi DEGE Ondokuz Mayıs Üniversitesi 0000-0003-0660-4721
Crystallography, Molecular Docking, Nonlinear Optics and Spectroscopy, Material Physics, Condensed Matter Physics
Dr. Tuba ALAGÖZ SAYIN It is not affiliated with an institution
Inorganic Chemistry, Physical Chemistry
Yavar AZAR
Yehya Kamal AL-BAYATİ
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Journal Full Title: Turkish Computational and Theoretical Chemistry


Journal Abbreviated Title: Turkish Comp Theo Chem (TC&TC)