| Understanding the influence of hydrogen bonding and diisocyanate symmetry on the morphology and properties of segmented polyurethanes and polyureas: Computational and … S Sami, E Yildirim, M Yurtsever, E Yurtsever, E Yilgor, I Yilgor, GL Wilkes Polymer 55 (18), 4563-4576, 2014 | 109 | 2014 |
| A DFT study of polymerization mechanisms of indole M Yurtsever, E Yurtsever Polymer 43 (22), 6019-6025, 2002 | 77 | 2002 |
| Bosonic helium droplets with cationic impurities: onset of electrostriction and snowball effects from quantum calculations E Coccia, E Bodo, F Marinetti, FA Gianturco, E Yildrim, M Yurtsever, ... The Journal of chemical physics 126 (12), 124319, 2007 | 54 | 2007 |
| Molecular dynamics simulation of water diffusion in MFI-type zeolites MU Arı, MG Ahunbay, M Yurtsever, A Erdem-Senatalar The Journal of Physical Chemistry B 113 (23), 8073-8079, 2009 | 48 | 2009 |
| A self-healing and highly stretchable polyelectrolyte hydrogel via cooperative hydrogen bonding as a superabsorbent polymer E Su, M Yurtsever, O Okay Macromolecules 52 (9), 3257-3267, 2019 | 41 | 2019 |
| Binding interactions of dopamine and apomorphine in D2High and D2Low states of human dopamine D2 receptor using computational and experimental techniques S Durdagi, RE Salmas, M Stein, M Yurtsever, P Seeman ACS Chemical Neuroscience 7 (2), 185-195, 2016 | 39 | 2016 |
| Effect of intersegmental interactions on the morphology of segmented polyurethanes with mixed soft segments: A coarse-grained simulation study E Yildirim, M Yurtsever, GL Wilkes, I Yilgör Polymer 90, 204-214, 2016 | 35 | 2016 |
| Investigation of inhibition mechanism of chemokine receptor CCR5 by micro-second molecular dynamics simulations RE Salmas, M Yurtsever, S Durdagi Scientific reports 5 (1), 1-12, 2015 | 34 | 2015 |
| Tetrameric Iridium Hydride‐Rich Clusters Formed under Hydrogenation Conditions Y Xu, MA Celik, AL Thompson, H Cai, M Yurtsever, B Odell, JC Green, ... Angewandte Chemie International Edition 48 (3), 582-585, 2009 | 34 | 2009 |
| Microsolvation of Li+ in Small He Clusters. Li+Hen Species from Classical and Quantum Calculations C Di Paola, F Sebastianelli, E Bodo, I Baccarelli, FA Gianturco, ... Journal of chemical theory and computation 1 (5), 1045-1054, 2005 | 34 | 2005 |
| Bosonic helium clusters doped by alkali metal cations: interaction forces and analysis of their most stable structures F Marinetti, E Coccia, E Bodo, FA Gianturco, E Yurtsever, M Yurtsever, ... Theoretical Chemistry Accounts 118 (1), 53-65, 2007 | 28 | 2007 |
| Structural studies of polypyrroles: II. a Monte Carlo growth approach to the branch formation E Yurtsever, O Esentürk, HÖ Pamuk, M Yurtsever Synthetic metals 98 (3), 229-236, 1999 | 26 | 1999 |
| Modeling and protein engineering studies of active and inactive states of human dopamine D2 receptor (D2R) and investigation of drug/receptor interactions RE Salmas, M Yurtsever, M Stein, S Durdagi Molecular diversity 19 (2), 321-332, 2015 | 25 | 2015 |
| Elucidation of conformational states, dynamics, and mechanism of binding in human κ-opioid receptor complexes G Leonis, A Avramopoulos, RE Salmas, S Durdagi, M Yurtsever, ... Journal of chemical information and modeling 54 (8), 2294-2308, 2014 | 25 | 2014 |
| The role of diisocyanate and soft segment on the intersegmental interactions in urethane and urea based segmented copolymers: A DFT study E Yildirim, M Yurtsever Computational and Theoretical Chemistry 1035, 28-38, 2014 | 25 | 2014 |
| Silver–Sodium ion exchange dynamics in LTA zeolite membranes R Ekhteiari Salmas, B Demir, E Yıldırım, A Sirkecioglu, M Yurtsever, ... The journal of physical chemistry C 117 (4), 1663-1671, 2013 | 25 | 2013 |
| Multiscale modeling of the morphology and properties of segmented silicone-urea copolymers E Yildirim, M Yurtsever, E Yurtsever, I Yilgor, E Yilgor Journal of Inorganic and Organometallic Polymers and Materials 22 (3), 604-616, 2012 | 25 | 2012 |
| Metal-catalyzed cyclization reactions of carbonyl ylides: Synthesis and DFT study of mechanisms MA Celik, M Yurtsever, NŞ Tüzün, FŞ Güngör, Ö Sezer, O Anaç Organometallics 26 (12), 2978-2985, 2007 | 25 | 2007 |
| Structural studies of polypyrroles: I. An ab-initio evaluation of bonding through α and β carbons M Yurtsever, E Yurtsever Synthetic Metals 98 (3), 221-227, 1999 | 25 | 1999 |
| Microsolvation of Li+ in bosonic helium clusters. I. Many-body effects on the structures of the small aggregates F Sebastianelli, E Bodo, I Baccarelli, C Di Paola, FA Gianturco, ... Computational materials science 35 (3), 261-267, 2006 | 24 | 2006 |
