Simona Golic Grdadolnik

Publication Activity (10 Years)

Years Active: 1997-2017
Publications (10 Years): 2

Top Topics

Computationally Expensive

Nuclear Magnetic Resonance

Protein Folding

Top Venues

J. Chem. Inf. Model.

J. Comput. Aided Mol. Des.

Publications

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) (2017)
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) (2015)
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) (2014)
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) (2012)
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) (2011)
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
Docking, and Molecular Dynamics Simulations. J. Chem. Inf. Model. 49 (3) (2009)
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) (1997)
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) (1997)