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ORCIDSimona Golic Grdadolnik
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Journal Articles
- 2017
[j8]Golfo G. Kordopati
, Haralambos Tzoupis, Anastassios N. Troganis, Gerasimos M. Tsivgoulis, Simona Golic Grdadolnik, Carmen Simal, Theodore V. Tselios:
Biologically relevant conformational features of linear and cyclic proteolipid protein (PLP) peptide analogues obtained by high-resolution nuclear magnetic resonance and molecular dynamics. J. Comput. Aided Mol. Des. 31(9): 841-854 (2017)- 2015
- [j7]Andrej Perdih, Martina Hrast, Kaja Pureber, Hélène Barreteau, Simona Golic Grdadolnik, Darko Kocjan, Stanislav Gobec, Tomaz Solmajer, Gerhard Wolber:
Furan-based benzene mono- and dicarboxylic acid derivatives as multiple inhibitors of the bacterial Mur ligases (MurC-MurF): experimental and computational characterization. J. Comput. Aided Mol. Des. 29(6): 541-560 (2015) - 2014
- [j6]Urska Zelenko, Milan Hodoscek, Damjana Rozman, Simona Golic Grdadolnik:
Structural Insight into the Unique Binding Properties of Pyridylethanol(phenylethyl)amine Inhibitor in Human CYP51. J. Chem. Inf. Model. 54(12): 3384-3395 (2014) - 2012
- [j5]Eleni Vrontaki, Georgios Leonis, Manthos G. Papadopoulos, M. Simcic, Simona Golic Grdadolnik, Antreas Afantitis, Georgia Melagraki, S. K. Hadjikakou, Thomas M. Mavromoustakos:
Comparative Binding Effects of Aspirin and Anti-Inflammatory Cu Complex in the Active Site of LOX-1. J. Chem. Inf. Model. 52(12): 3293-3301 (2012) - 2011
- [j4]Constantinos Potamitis, Minos-Timotheos Matsoukas, Theodore V. Tselios, Thomas M. Mavromoustakos, Simona Golic Grdadolnik:
Conformational analysis of the ΜΒΡ83-99 (Phe91) and ΜΒΡ83-99 (Tyr91) peptide analogues and study of their interactions with the HLA-DR2 and human TCR receptors by using Molecular Dynamics. J. Comput. Aided Mol. Des. 25(9): 837-853 (2011) - 2009
- [j3]Constantinos Potamitis, Maria Zervou, Vassilis Katsiaras, Panagiotis Zoumpoulakis, Serdar Durdagi, Manthos G. Papadopoulos, Joseph M. Hayes, Simona Golic Grdadolnik, Ioanna Kyrikou, Dimitris Argyropoulos, Georgia Vatougia, Thomas M. Mavromoustakos:
Antihypertensive Drug Valsartan in Solution and at the AT1 Receptor: Conformational Analysis, Dynamic NMR Spectroscopy, in Silico Docking, and Molecular Dynamics Simulations. J. Chem. Inf. Model. 49(3): 726-739 (2009) - 1997
- [j2]Simona Golic Grdadolnik, P. Trebe, M. Kocevar, Tomaz Solmajer:
Structural Investigation of 5-Hydrazono-5, 6, 7, 8-tetrahydro-2H-1-benzopyran-2-ones and 5, 6, 7, 8-Tetrahydroquinoline-2, 5(1H)-diones. J. Chem. Inf. Comput. Sci. 37(3): 489-494 (1997) - [j1]Simona Golic Grdadolnik, Dale F. Mierke:
Structural Characterization of the Molecular Dimer of the Peptide Antibiotic Vancomycin by Distance Geometry in Four Spatial Dimensions. J. Chem. Inf. Comput. Sci. 37(6): 1044-1047 (1997)
Coauthor Index
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