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Yarkın Aybars  Çetin, PhD
Yarkın Aybars Çetin, PhD
Rovira i Virgili University | orcid.org/0000-0003-2456-5949
在 urv.cat 的电子邮件经过验证 - 首页
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Volatile organic compounds of Metarhizium brunneum influence the efficacy of entomopathogenic nematodes in insect control
EH Hummadi, A Dearden, T Generalovic, B Clunie, A Harrott, Y Cetin, ...
Biological Control 155, 104527, 2021
612021
Complete Dynamic Reconstruction of C60, C70, and (C59N)2 Encapsulation into an Adaptable Supramolecular Nanocapsule
C García-Simón, C Colomban, YA Çetin, A Gimeno, M Pujals, E Ubasart, ...
Journal of the American Chemical Society 142 (37), 16051-16063, 2020
392020
Antimicrobial volatiles of the insect pathogen Metarhizium brunneum
EH Hummadi, Y Cetin, M Demirbek, NM Kardar, S Khan, CJ Coates, ...
Journal of Fungi 8 (4), 326, 2022
292022
A computational view on nanomaterial intrinsic and extrinsic features for nanosafety and sustainability
G Mancardi, A Mikolajczyk, VK Annapoorani, A Bahl, K Blekos, J Burk, ...
Materials Today 67, 344-370, 2023
202023
Analyzing the TiO2 surface reactivity based on oxygen vacancies computed by DFT and DFTB methods
YA Çetin, B Martorell, F Serratosa, N Aguilera-Porta, M Calatayud
Journal of Physics: Condensed Matter 34 (31), 314004, 2022
182022
Prediction of Electronic Density of States in Guanine-TiO2 Adsorption Model based on Machine Learning
YA Çetin, B Martorell, F Serratosa
Computational and Structural Biotechnology Reports, 100008, 2024
32024
Adsorption of Guanine on Oxygen-Deficient TiO2 Surface: A Combined MD-DFTB/DFT Strategy
YA Çetin, B Martorell, F Serratosa, M Calatayud
ACS omega 9 (37), 39043-39050, 2024
12024
INVESTIGATION OF ANTIOXIDANT EFFECTS OF VARIOUS ORGANIC OIL COMPONENTS BY THEORETICAL METHODS
VE ATALAY, MG DEMIRBEK, YA ÇETIN, İB ÖLÜ
Rev. Roum. Chim 67 (8-9), 439-446, 2022
12022
Revisiting Water Adsorption on TiO2 and ZnO Surfaces: An SCC-DFTB Molecular Dynamics Study
YA Çetin, L Escorihuela, B Martorell, F Serratosa
ACS Omega, 2025
2025
Computational Models based on First-Principles Calculations for In-Silico Evaluation of Nano-compounds Toxicity
YA Çetin
Universitat Rovira i Virgili, 2024
2024
Replication Data for: Revisiting Water Adsorption on TiO2 and ZnO Surfaces: A SCC-DFTB Molecular Dynamics Study
YA Çetin, L Escorihuela Martí, B Martorell Masip, ...
2024
Machine Learning Prediction for Electronic Density of States in Guanine-TiO2 Adsorption Model
YA Çetin, S Casanelles, B Martorell Masip
2024
New descriptors in toxicology prediction of nanomaterials: Using quasi-ab initio MD simulations for the estimation of aqueous ZnO and TiO2 surface structure parameters
YA Çetin, S Casanelles, B Martorell Masip, L Escorihuela
2024
Investigating quantitative genotoxicity indicators by DFT analysis of TiO2 surface
YA Çetin, L Escorihuela, B Martorell Masip, M Calatayud, F Serratosa
2024
SCC-DFTB/MD simulation: guanine-TiO2 adsorption model
YA Çetin
https://doi.org/10.34810/data1312, 2024
2024
Proposing genotoxicity related quantitative indicators by analyzing TiO2 surface computed on DFT framework
YA Çetin, L Escorihuela, B Martorell Masip, M Calatayud, F Serratosa
2024
Replication Data for: Prediction of Electronic Density of States in Guanine-TiO2 Adsorption Model based on Machine Learning
YA Çetin, B Martorell Masip, F Serratosa
Universitat Rovira i Virgili, 2024
2024
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