Collect. Czech. Chem. Commun. 2011, 76, 605-618
https://doi.org/10.1135/cccc2011033
Published online 2011-04-29 13:20:07

How to fragment a polypeptide? An ab initio computational study of pair interactions between amino acids and ligand-amino acids in proteins

Vojtěch Klusáka, Petr Dobešb, Jiří Černýc and Jiří Vondrášeka,*

a Institute of Organic Chemistry and Biochemistry, Academy of Sciences of the Czech Republic, v.v.i., Flemingovo nám. 2, 166 10 Prague, Czech Republic
b University Hospital Brno, Department of Internal Medicine – Hematooncology, Jihlavská 20, 625 00 Brno, Czech Republic
c Institute of Biotechnology, Academy of Sciences of the Czech Republic, v.v.i., Vídeňská 1083, 142 20 Prague 4, Czech Republic

Individual author index pages


Other CCCC articles of these authors

  • Jan Řezáč, Petr Jurečka, Kevin E. Riley, Jiří Černý, Haydee Valdes, Kristýna Pluháčková, Karel Berka, Tomáš Řezáč, Michal Pitoňák, Jiří Vondrášek and Pavel Hobza*
    Quantum Chemical Benchmark Energy and Geometry Database for Molecular Clusters and Complex Molecular Systems (www.begdb.com): A Users Manual and Examples
    2008, Vol. 73, Issue 10, pp. 1261–1270 [Abstract] [Full text pdf]
  • Jan Řezáč, Karel Berka, Dominik Horinek, Pavel Hobza* and Jiří Vondrášek*
    The Stabilization Energy of the GLU-LYS Salt Bridge in the Protein/Water Environment: Correlated Quantum Chemical ab initio, DFT and Empirical Potential Studies
    2008, Vol. 73, Issue 6-7, pp. 921–936 [Abstract]