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| 1. | Fast QM/MM method and its application to molecular systems
CHEMICAL PHYSICS LETTERS Tom 397 r. 2004, str. 451-458 (Artykuł) Łukasz Walewski, Piotr Bala, M. Elstner, Th. Frauenheim, Bogdan Lesyng | |
| 2. | EUROGRID - European Computational Grid Testbed
JOURNAL OF PARALLEL AND DISTRIBUTED COMPUTING Tom 63 Nr 5 r. 2003, str. 590-596 (Artykuł) Bogdan Lesyng, Piotr Bala, Dietmar Erwin | |
| 3. | Molecular Dynamics Simulations of the First Steps of the Reaction Catalyzed by HIV-1 Protease
BIOPHYSICAL JOURNAL Tom 83 Nr 2 r. 2002, str. 794-807 (Artykuł) Joanna Trylska, Piotr Bala, Maciej Geller, Paweł Grochowski | |
| 4. | Quantum-Dynamical Picture of a Multi-Step Enzymatic Process. Reaction Catalyzed by Phospholipase A2
BIOPHYSICAL JOURNAL Tom 79 Nr 3 r. 2000, str. 1253-1262 (Artykuł) Piotr Bala, Paweł Grochowski, Krzysztof Nowiński, Bogdan Lesyng, J McCammon | |
| 5. | Advanced Calculations and Visualisation of Enzymatic Reactions Using a Combined Quantum Classical Molecular Dynamics
LECTURE NOTES IN COMPUTER SCIENCE Nr 1541 r. 1998, str. 20-26 (Artykuł) Piotr Bala, T Clark, Paweł Grochowski, Krzysztof Nowiński, Bogdan Lesyng, J McCammon | |
| 6. | Quantum Dynamics of Proton Transfer Processes in Enzymatic Reactions. Simulations of Phospholipase A2
BERICHTE DER BUNSEN-GESSELSCHAFT - PHYSICAL CHEMISTRY Tom 102 Nr 3 r. 1998, str. 580-586 (Artykuł) Piotr Bala, Paweł Grochowski, Bogdan Lesyng, J McCammon | |
| 7. | Density Functional based parametrization of a Valence Bond Method and its Applications in Quantum-Classical Molecular Dynamics Simulations of Enzymatic Reactions
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY Tom 60 r. 1996, str. 1134-1164 (Artykuł) Paweł Grochowski, Bogdan Lesyng, Piotr Bala, J McCammon | |
| 8. | Dynamics Simulations of Proton Transfer Process in Molecular Complexes and in Enzymes
JOURNAL OF PHYSICAL CHEMISTRY B Tom 100 r. 1996, str. 2535-2545 (Artykuł) Piotr Bala, Paweł Grochowski, Bogdan Lesyng, J McCammon | |
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| 9. | Interactive Visualization for the UNICORE Grid Environment
w: Computational Science - ICCS 2004, PT1, Proceedings Lecture Notes in Computer Science, str. 99-106, r. 2004 (Artykuł) Piotr Bala, K Benedykczak, Aleksander Nowiński, Krzysztof Nowiński, J Wypychowski | |
| 10. | GRID Solutions at ICM: a Contribution to European Resources and Services
w: 4th Global Research Village Conference - Importance of ICT for Research and Science, str. 161-172, Information Processing Centre, Warsaw, r. 2003 (Artykuł konferencyjny) Piotr Bala, Bogdan Lesyng, Marek Niezgódka | |
| 11. | Approximate Valence Bond Method - A Fast Generator of Quantum Potentials for Molecular Simulations
w: Modelling and Simulation: A Tool for the Next Millenium, 13th European Simulation Multiconference, June 1-4, 1999, Warsaw, Poland, str. 181-183, Society for Computer Simulation International, r. 1999 (Komunikat) Piotr Bala, Maciej Geller, Krzysztof Ginalski, Paweł Grochowski, Joanna Trylska, Bogdan Lesyng | |
| 12. | Biblioteki wirtualne. Fikcja czy rzeczywistość następnego stulecia
w: INFOBAZY, str. 25-38, r. 1999 (Artykuł konferencyjny) Paweł Grochowski, Bogdan Lesyng, Piotr Bala | |
| 13. | QCMD/ AVB and MD/ AVB Models - Tools for studying enzymatic reactions
w: 5th International Conference: Computers in Chemistry, str. 5-5, ., r. 1999 (Komunikat) Piotr Bala, Paweł Grochowski, Krzysztof Nowiński, Bogdan Lesyng | |
| 14. | Recent Developments in QCMD/ AVB and MD/ AVB as a Tool for Studying Proton Transfer Processes in Enzymatic Reactions
w: 13th International Conference - Workshop: Horizons in Hydrogen Bond Research, September 2-9, 1999, wieradów Zdrój, str. P4-P4, ., r. 1999 (Komunikat) Piotr Bala, Paweł Grochowski, Krzysztof Nowiński, Bogdan Lesyng | |
| 15. | Quantum-Classical Molecular Dynamics. Models and Biological Applications
w: Molecular Structure and Dynamics in Biology, str. 24-24, r. 1998 (Komunikat) Piotr Bala, Paweł Grochowski, Bogdan Lesyng, J McCammon | |
| 16. | Parallel Version of a Quantum-Classical Molecular Dynamics Code for Complex Molecular and Biomolecular systems
w: Lecture Notes in Computer Science, str. 409-416, Springer, r. 1997 (Artykuł) Piotr Bala, T Clark, Paweł Grochowski, Bogdan Lesyng, J McCammon | |
| 17. | Recent Advances in Parallel Virtual Machine and Message Passing Interface
w: Parallel Version of the Combined Quantum Classical Molecular Dynamics Code for Complex Molecular and Biomolecular Systems, str. 1-1, Springer-Verlag, r. 1997 (Artykuł) Piotr Bala, T Clark, Paweł Grochowski, Bogdan Lesyng, J McCammon | |