| ||
| 26. | Implementation of a symplectic multiple-time-step molecular dunamics algorithm, based on the united-residue mesoscopic potential energy function
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JOURNAL OF CHEMICAL PHYSICS Tom 125 Nr 20 r. 2006, str. 204107 / 1-10 (Artykuł) Franciszek Rakowski, Paweł Grochowski, Bogdan Lesyng, Adam Liwo, Harold Scheraga | |
| 27. | Parallelization of the Quantum Dynamics Code for Cluster Architecture and its Applications to the Gross-Pitaevskii Equation
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY Tom 106 r. 2006, str. 664-669 (Artykuł) Adam Górecki, Piotr Bała, Bogdan Lesyng | |
| 28. | SCC-DFTB Energy Barriers for Single and Double Proton Transfer Processes in the Model Molecular Systems Malonaldehyde and Porphycene
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY Tom 106 r. 2006, str. 636-640 (Artykuł) Łukasz Walewski, D Krachtus, S Fischer, J Smith, Piotr Bała, Bogdan Lesyng | |
| 29. | Classification and Characterization of Natural Protein Inhibitors of Protein Kinases
CELLULAR & MOLECULAR BIOLOGY LETTERS Tom 10 Nr Suppl 2 r. 2005, str. 137-138 (Komunikat) Agata Meglicz, Jacek Leluk, Bogdan Lesyng | |
| 30. | Parallelization of the Quantum Dynamics Code for Cluster Architecture and its Applications to the Gross-Pitaevskii Equation
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY Tom 104 r. 2005, str. 0000-0000 (Artykuł) Adam Górecki, Piotr Bała, Bogdan Lesyng | |
| 31. | SCC-DFTB Energy Barriers for Single and Double Proton Transfer Processes in the Model Molecular Systems Malonaldehyde and Porphycyne
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY Tom 104 r. 2005, str. 000-000 (Artykuł konferencyjny) Łukasz Walewski, Piotr Bała, M Elstner, Th Frauenheim, Bogdan Lesyng | |
| 32. | A Java-implementation of a genetic semihomology algorithm (GEISHA), and its applications for analyses of selected protein families
EUROPEAN JOURNAL OF BIOCHEMISTRY Tom 271 Nr Supplement r. 2004, str. 30-30 (Komunikat) Adam Górecki, Jacek Leluk, Bogdan Lesyng | |
| 33. | Class IV charge model for the self-consistent charge density-functional tight-binding method
JOURNAL OF PHYSICAL CHEMISTRY A Tom 108 r. 2004, str. 2545-2549 (Artykuł) Jarosław Kalinowski, Bogdan Lesyng, J.D. Thompson, C. Cramer, D.G. Truhlar | |
| 34. | Construction of consensus sequences of the b-spectrin family with variable parameter-thresholds and validation of the applied procedure
EUROPEAN JOURNAL OF BIOCHEMISTRY Tom 271 Nr Supplement r. 2004, str. 29-30 (Komunikat) Anna Fogtman, Jacek Leluk, Bogdan Lesyng | |
| 35. | 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 | |
| 36. | Generalized Born Model: Analysis, Refinement and Applications to Proteins
JOURNAL OF PHYSICAL CHEMISTRY B Tom 108 r. 2004, str. 18368-18376 (Artykuł) Michał Wojciechowski, Bogdan Lesyng | |
| 37. | Protein inhibitors of kinases - homology analysis, mechanisms of differentiation and correlated mutations
EUROPEAN JOURNAL OF BIOCHEMISTRY Tom 271 Nr Supplement r. 2004, str. 30-30 (Komunikat) Agata Meglicz, Jacek Leluk, Bogdan Lesyng | |
| 38. | A comparative study of the primary structures of protein and sugar kinases
CELLULAR & MOLECULAR BIOLOGY LETTERS Tom 82 Nr 2A r. 2003, str. 620-621 (Artykuł konferencyjny) Jacek Leluk, Bogdan Lesyng | |
| 39. | 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 | |
| 40. | Extended Hellmann-Feynman forces, canonical representations, and exponential propagators in the mixed quantum-classical molecular dynamics
JOURNAL OF CHEMICAL PHYSICS Tom 119 Nr 22 r. 2003, str. 11541-11555 (Artykuł) Paweł Grochowski, Bogdan Lesyng | |
| 41. | Prediction of Secondary Ionization of the Phosphate Group in Phosphotyrosine Peptides
BIOPHYSICAL JOURNAL Tom 84 Nr 2 r. 2003, str. 750-756 (Artykuł) Michał Wojciechowski, Tomasz Grycuk, Jan Antosiewicz, Bogdan Lesyng | |
| 42. | SCC DFT-TB energy calculations of the phosphoryl transfer reaction in the PKA active site
CELLULAR & MOLECULAR BIOLOGY LETTERS Tom 8 Nr 2A r. 2003, str. 603-604 (Inne) Franciszek Rakowski, Paweł Grochowski, Bogdan Lesyng | |
| 43. | DFT calculations and parametrization of the approximate Valence Bond method to describe the phosphoryl transfer reaction in a model system
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY Tom 90 r. 2002, str. 1129-1139 (Artykuł) Krzysztof Ginalski, Paweł Grochowski, Bogdan Lesyng, David Shugar | |
| 44. | Modelling the 3D structure of protein kinase C gamma and its interaction with specific Inhibitor, chelerythrine
CELLULAR & MOLECULAR BIOLOGY LETTERS Tom 6 Nr 2B r. 2001, str. 548-548 (Komunikat) Paweł Brodacki, Krzysztof Ginalski, Bogdan Lesyng | |
| 45. | Onkogenic activation caused by point mutations in the kinase domain of the met proto-oncogene: Molecular modeling studies
CELLULAR & MOLECULAR BIOLOGY LETTERS Tom 6 Nr 2B r. 2001, str. 550-550 (Komunikat) Maria Miller, Krzysztof Ginalski, Bogdan Lesyng, Noboru Nakaigawa, Laura Schmidt, Berton Zbar | |
| 46. | Prediction of protonation states of phosphotyrosine in short peptides and proteins
CELLULAR & MOLECULAR BIOLOGY LETTERS Tom 6 Nr 2B r. 2001, str. 552-553 (Komunikat) Michał Wojciechowski, Tomasz Grycuk, Jan Antosiewicz, Bogdan Lesyng | |
| 47. | Quantum-mechanical calculations of the potential energy function for the phosphate transfer in model systems
CELLULAR & MOLECULAR BIOLOGY LETTERS Tom 6 Nr 2B r. 2001, str. 549-549 (Komunikat) Krzysztof Ginalski, Paweł Grochowski, Bogdan Lesyng | |
| 48. | Structural basis of oncogenic activation caused by point mutations in the kinase domain of the MET proto-oncogene: Modeling studies.
PROTEINS-STRUCTURE FUNCTION AND BIOINFORMATICS Nr 44 r. 2001, str. 32-43 (Artykuł) Maria Miller, Krzysztof Ginalski, Bogdan Lesyng, Noboru Nakaigawa, Laura Schmidt, Breton Zbar | |
| 49. | A Mezoscopic Model of Nucleic Acids. Part 1. Lagrangian and Quaternion Molecular Dynamics
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS Tom 17 Nr 6 r. 2000, str. 1097-1108 (Artykuł) Witold Rudnicki, Grzegorz Bakalarski, Bogdan Lesyng | |
| 50. | A Mezoscopic Model of Nucleic Acids. Part 2. An Effective Potential Energy Function for DNA
JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS Tom 17 Nr 6 r. 2000, str. 1109-1115 (Artykuł) Maciej Maciejczyk, Witold Rudnicki, Bogdan Lesyng | |