2008 |
3 | EE | Ales Krenek,
Martin Petrek,
Jan Kmunícek,
Jiri Filipovic,
Zdenek Sustr,
Frantisek Dvorák,
Jirí Sitera,
Jiri Wiesner,
Ludek Matyska:
Multiple Ligand Trajectory Docking Study - Semiautomatic Analysis of Molecular Dynamics Simulations using EGEE gLite Services.
PDP 2008: 447-454 |
2004 |
2 | EE | Petr Dobes,
Jan Kmunícek,
Vladimír Mikes,
Jirí Damborský:
Binding of Fatty Acids to beta-Cryptogein: Quantitative Structure-Activity Relationships and Design of Selective Protein Mutants.
Journal of Chemical Information and Modeling 44(6): 2126-2132 (2004) |
2003 |
1 | | Jan Kmunícek,
Michal Bohác,
Santos Luengo,
Federico Gago,
Rebecca C. Wade,
Jirí Damborský:
Comparative binding energy analysis of haloalkane dehalogenase substrates: Modelling of enzyme-substrate complexes by molecular docking and quantum mechanical calculations.
Journal of Computer-Aided Molecular Design 17(5-6): 299-311 (2003) |