Zobrazeno 1 - 3
of 3
pro vyhledávání: '"Nathaniel A. Paddock"'
Autor:
Markus M. Hoffmann, Matthew D. Too, Nathaniel A. Paddock, Robin Horstmann, Sebastian Kloth, Michael Vogel, Gerd Buntkowsky
Publikováno v:
Molecules, Vol 29, Iss 9, p 2070 (2024)
Polyethylene glycol (PEG) is one of the environmentally benign solvent options for green chemistry. It readily absorbs water when exposed to the atmosphere. The Molecular Dynamics (MD) simulations of PEG200, a commercial mixture of low molecular weig
Externí odkaz:
https://doaj.org/article/e7d3b13da855465ba26d18b63e7b6db7
Autor:
Markus M. Hoffmann, Nathaniel P. Randall, Miray H. Apak, Nathaniel A. Paddock, Torsten Gutmann, Gerd Buntkowsky
Publikováno v:
Journal of Solution Chemistry. 52:685-707
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::615c29eca59ace636847c0021a6564de
https://doi.org/10.1007/s10953-023-01265-4
https://doi.org/10.1007/s10953-023-01265-4
Autor:
Markus M. Hoffmann, Matthew D. Too, Nathaniel A. Paddock, Robin Horstmann, Sebastian Kloth, Michael Vogel, Gerd Buntkowsky
Files needed for molecular simulation using GROMACS (top, gro, itp files) of polyethylene glycol (PEG200) Bash and python scripts to analyze obtained simulation trajectories
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5901106a950b9e8c74f80f5a3cef59c8
https://zenodo.org/record/7540727
https://zenodo.org/record/7540727
