| Gramicidin A channel as a test ground for molecular dynamics force fields TW Allen, T Baştuğ, S Kuyucak, SH Chung Biophysical Journal 84 (4), 2159-2168, 2003 | 136 | 2003 |
| Potential of mean force calculations of ligand binding to ion channels from Jarzynski’s equality and umbrella sampling T Baştuğ, PC Chen, SM Patra, S Kuyucak The Journal of chemical physics 128 (15), 2008 | 120 | 2008 |
| All-electron Dirac—Fock—Slater SCF calculations of the Au2 molecule T Baştuǧ, D Heinemann, WD Sepp, D Kolb, B Fricke Chemical physics letters 211 (1), 119-124, 1993 | 91 | 1993 |
| Four-component relativistic density functional calculations of heavy diatomic molecules S Varga, B Fricke, H Nakamatsu, T Mukoyama, J Anton, D Geschke, ... The Journal of Chemical Physics 112 (8), 3499-3506, 2000 | 87 | 2000 |
| The electronic structure and properties of group 8 oxides where M=Ru, Os, and Element 108, Hs V Pershina, T Bastug, B Fricke, S Varga The Journal of Chemical Physics 115 (2), 792-799, 2001 | 83 | 2001 |
| Intermetallic compounds of the heaviest elements: the electronic structure and bonding of dimers of element 112 and its homolog Hg V Pershina, T Bastug, T Jacob, B Fricke, S Varga Chemical physics letters 365 (1-2), 176-183, 2002 | 63 | 2002 |
| Relativistic effects on experimentally studied gas-phase properties of the heaviest elements V Pershina, T Bastug Chemical physics 311 (1-2), 139-150, 2005 | 61 | 2005 |
| Relativistic effects in physics and chemistry of element 105. III. Electronic structure of hahnium oxyhalides as analogs of group 5 elements oxyhalides V Pershina, WD Sepp, T Bastug, B Fricke, GV Ionova The Journal of chemical physics 97 (2), 1123-1131, 1992 | 57 | 1992 |
| Energetics of ion permeation, rejection, binding, and block in gramicidin A from free energy simulations T Baştuğ, S Kuyucak Biophysical journal 90 (11), 3941-3950, 2006 | 56 | 2006 |
| Temperature dependence of the transport coefficients of ions from molecular dynamics simulations T Baştuğ, S Kuyucak Chemical physics letters 408 (1-3), 84-88, 2005 | 55 | 2005 |
| Role of protein flexibility in ion permeation: a case study in gramicidin A T Baştuğ, A Gray-Weale, SM Patra, S Kuyucak Biophysical journal 90 (7), 2285-2296, 2006 | 52 | 2006 |
| Maple procedures for the coupling of angular momenta. V. Recoupling coefficients S Fritzsche, T Inghoff, T Bastug, M Tomaselli Computer Physics Communications 139 (3), 314-326, 2001 | 48 | 2001 |
| The electronic structure and properties of group 7 oxychlorides, MO3Cl, where M= Tc, Re, and element 107, Bh V Pershina, T Bastug The Journal of Chemical Physics 113 (4), 1441-1446, 2000 | 48 | 2000 |
| Role of the dielectric constants of membrane proteins and channel water in ion permeation T Baştuğ, S Kuyucak Biophysical journal 84 (5), 2871-2882, 2003 | 47 | 2003 |
| Free energy simulations of ligand binding to the aspartate transporter GltPh G Heinzelmann, T Baştuğ, S Kuyucak Biophysical Journal 101 (10), 2380-2388, 2011 | 46 | 2011 |
| Solution chemistry of element 105. Part III: Hydrolysis and complex formation of Nb, Ta, Db and Pa in HF and HBr solutions V Pershina, T Bastug Radiochimica Acta 84 (2), 79-84, 1999 | 46 | 1999 |
| Relativistic effects on the electronic structure and volatility of group-8 tetroxides MO4, where M= Ru, Os, and element 108, Hs V Pershina, T Bastug, B Fricke The Journal of chemical physics 122 (12), 2005 | 40 | 2005 |
| Physics of ion channels S Kuyucak, T Bastug Journal of Biological Physics 29, 429-446, 2003 | 40 | 2003 |
| Free energy simulations of single and double ion occupancy in gramicidin A T Baştuğ, S Kuyucak The Journal of chemical physics 126 (10), 2007 | 39 | 2007 |
| Adsorption of CO on cluster models of platinum (111): A four-component relativistic density-functional approach D Geschke, T Baştuğ, T Jacob, S Fritzsche, WD Sepp, B Fricke, S Varga, ... Physical Review B 64 (23), 235411, 2001 | 39 | 2001 |
Swarna M PatraUniversity of Sydney, IISC, RV College of Engineering,在 rvce.edu.in 的电子邮件经过验证
