Fast-dissolving electrospun gelatin nanofibers encapsulating ciprofloxacin/cyclodextrin inclusion complex Z Aytac, S Ipek, I Erol, E Durgun, T Uyar Colloids and Surfaces B: Biointerfaces 178, 129-136, 2019 | 105 | 2019 |
Computational insights into the protonation states of catalytic dyad in BACE1–acyl guanidine based inhibitor complex A Kocak, I Erol, M Yildiz, H Can Journal of Molecular Graphics and Modelling 70, 226-235, 2016 | 41 | 2016 |
Near-physiological-temperature serial crystallography reveals conformations of SARS-CoV-2 main protease active site for improved drug repurposing S Durdagi, Ç Dağ, B Dogan, M Yigin, T Avsar, C Buyukdag, I Erol, ... Structure 29 (12), 1382-1396. e6, 2021 | 33 | 2021 |
In silico analysis of bacteriocins from lactic acid bacteria against SARS-CoV-2 I Erol, SE Kotil, O Fidan, AE Yetiman, S Durdagi, F Ortakci Probiotics and antimicrobial proteins 15 (1), 17-29, 2023 | 31 | 2023 |
Targeting the NF-κB/IκBα complex via fragment-based E-Pharmacophore virtual screening and binary QSAR models T Kanan, D Kanan, I Erol, S Yazdi, M Stein, S Durdagi Journal of Molecular Graphics and Modelling 86, 264-277, 2019 | 31 | 2019 |
Structure-based design of hERG-neutral antihypertensive oxazalone and imidazolone derivatives B Aksoydan, I Kantarcioglu, I Erol, RE Salmas, S Durdagi Journal of Molecular Graphics and Modelling 79, 103-117, 2018 | 27 | 2018 |
Analysis of the glutamate agonist LY404, 039 binding to nonstatic dopamine receptor D2 dimer structures and consensus docking RE Salmas, P Seeman, B Aksoydan, I Erol, I Kantarcioglu, M Stein, ... ACS Chemical Neuroscience 8 (6), 1404-1415, 2017 | 26 | 2017 |
Integration of multi-scale molecular modeling approaches with experiments for the in silico guided design and discovery of novel hERG-Neutral antihypertensive oxazalone and … S Durdagi, B Aksoydan, I Erol, I Kantarcioglu, Y Ergun, G Bulut, M Acar, ... European journal of medicinal chemistry 145, 273-290, 2018 | 24 | 2018 |
Thermodynamic and surface characterisation of 4-[4-((S)-citronellyloxy) benzoyloxy] benzoic acid thermotropic liquid crystal I Erol, F Cakar, H Ocak, H Cankurtaran, Ö Cankurtaran, B Bilgin-Eran, ... Liquid Crystals 43 (1), 142-151, 2016 | 22 | 2016 |
Oligomerization and cooperativity in GPCRs from the perspective of the angiotensin AT1 and dopamine D2 receptors S Durdagi, I Erol, RE Salmas, B Aksoydan, I Kantarcioglu Neuroscience Letters 700, 30-37, 2019 | 20 | 2019 |
Current status of multiscale simulations on GPCRs S Durdagi, B Dogan, I Erol, G Kayık, B Aksoydan Current opinion in structural biology 55, 93-103, 2019 | 17 | 2019 |
The signaling pathway of dopamine D2 receptor (D2R) activation using normal mode analysis (NMA) and the construction of pharmacophore models for D2R ligands RE Salmas, M Stein, M Yurtsever, P Seeman, I Erol, M Mestanoglu, ... Journal of Biomolecular Structure and Dynamics 35 (9), 2040-2048, 2017 | 17 | 2017 |
Toward Understanding the Impact of Dimerization Interfaces in Angiotensin II Type 1 Receptor I Erol, B Cosut, S Durdagi Journal of chemical information and modeling, 2019 | 15 | 2019 |
First universal pharmacophore model for hERG1 K+ channel activators: acthER S Durdagi, I Erol, RE Salmas, M Patterson, SY Noskov Journal of Molecular Graphics and Modelling 74, 153-170, 2017 | 9 | 2017 |
Identification of novel serotonin reuptake inhibitors targeting central and allosteric binding sites: A virtual screening and molecular dynamics simulations study I Erol, B Aksoydan, I Kantarcioglu, RE Salmas, S Durdagi Journal of Molecular Graphics and Modelling 74, 193-202, 2017 | 9 | 2017 |
Evolutionary association of receptor-wide amino acids with G protein–coupling selectivity in aminergic GPCRs B Selçuk, I Erol, S Durdağı, O Adebali Life Science Alliance 5 (10), 2022 | 8 | 2022 |
Exploring the binding capacity of lactic acid bacteria derived bacteriocins against RBD of SARS-CoV-2 Omicron variant by molecular simulations I Erol, SE Kotil, F Ortakci, S Durdagi Journal of Biomolecular Structure and Dynamics 41 (20), 10774-10784, 2023 | 4 | 2023 |
Indolyl imine substituted BODIPY systems; synthesis, photophysical, and biological properties E Ozcan, MF Saglam, HH Kazan, I Erol, IF Sengul, B Cosut Tetrahedron 137, 133367, 2023 | 4 | 2023 |
Near-physiological-temperature serial femtosecond X-ray crystallography reveals novel conformations of SARS-CoV-2 main protease active site for improved drug repurposing S Durdagi, C Dag, B Dogan, M Yigin, T Avsar, C Buyukdag, I Erol, B Ertem, ... bioRxiv, 2020.09. 09.287987, 2020 | 4 | 2020 |
Enterocin DD14 can inhibit the infection of eukaryotic cells with enveloped viruses R Teiar, F Sane, I Erol, MP Nekoua, D Lecouturier, R Boukherroub, ... Archives of Microbiology 206 (6), 269, 2024 | 3 | 2024 |