| 2004 |
|---|
| 5 | 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 |
|---|
| 4 | | 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) |
| 2000 |
|---|
| 3 | | Martin Prokop,
Jirí Damborský,
Jaroslav Koca:
TRITON: in silico construction of protein mutants and prediction of their activities.
Bioinformatics 16(9): 845-846 (2000) |
| 1998 |
|---|
| 2 | EE | Michal Kutý,
Jirí Damborský,
Martin Prokop,
Jaroslav Koca:
A Molecular Modeling Study of the Catalytic Mechanism of Haloalkane Dehalogenase. 2. Quantum Chemical Study of Complete Reaction Mechanism.
Journal of Chemical Information and Computer Sciences 38(4): 736-741 (1998) |
| 1997 |
|---|
| 1 | EE | Jirí Damborský,
Michal Kutý,
Miroslav Nemec,
Jaroslav Koca:
A Molecular Modeling Study of the Catalytic Mechanism of Haloalkane Dehalogenase: 1. Quantum Chemical Study of the First Reaction Step.
Journal of Chemical Information and Computer Sciences 37(3): 562-568 (1997) |
