Published January 16, 2023
| Version v1
Journal article
Open
On the Behavior of the Ethylene Glycol Components of Polydisperse Polyethylene Glycol PEG200
Creators
- 1. SUNY Brockport
- 2. TU Darmstadt
- 3. TU Darmstaadt
Description
Files needed for molecular simulation using GROMACS (top, gro, itp files) of polyethylene glycol (PEG200)
Bash and python scripts to analyze obtained simulation trajectories
Files
Files
(324.7 kB)
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Additional details
Related works
- Is supplement to
- Journal article: 10.1021/acs.jpcb.2c06773 (DOI)