dr inż. Joanna Grabowska
Zatrudnienie
- Adiunkt w Katedra Chemii Fizycznej
Media społecznościowe
Kontakt
- joanna.grabowska@pg.edu.pl
Adiunkt
- Miejsce pracy
-
Budynek A Wydz. Chemii
pokój 219 otwiera się w nowej karcie - joanna.grabowska@pg.edu.pl
Wybrane publikacje
-
Solubility of Methane in Water: Some Useful Results for Hydrate Nucleation
In this paper, the solubility of methane in water along the 400 bar isobar is determined by computer simulations using the TIP4P/Ice force field for water and a simple LJ model for methane. In particular, the solubility of methane in water when in contact with the gas phase and the solubility of methane in water when in contact with the hydrate has been determined. The solubility of methane in a gas–liquid system decreases as temperature...
-
Revealing the Frank–Evans “Iceberg” Structures within the Solvation Layer around Hydrophobic Solutes
Using computer simulations, the structural properties of solvation water of three model hydrophobic molecules, methane and two fullerenes (C60 and C80), were studied. Systems were simulated at temperatures in the range of 250−298 K. By analyzing both the local ordering of the molecules of water in the solvation layers and the structure of hydrogen bond network, it is shown that in the solvation layer of hydrophobic molecules, ordered...
-
Structure of solvation water around the active and inactive regions of a type III antifreeze protein and its mutants of lowered activity
Water molecules from the solvation shell of the ice-binding surface are considered important for the antifreeze proteins to perform their function properly. Herein, we discuss the problem whether the extent of changes of the mean properties of solvation water can be connected with the antifreeze activity of the protein. To this aim, the structure of solvation water of a type III antifreeze protein from Macrozoarces americanus (eel...
wyświetlono 1256 razy