Project ID: plumID:24.010
Name: Oxytocin metadynamics simulation
Archive: https://github.com/Jan8be/oxytocin_metadynamics/raw/main/oxytocin.zip
Category: bio
Keywords: metadynamics, oxytocin, peptide
PLUMED version: 2.5
Contributor: Jan Beránek
Submitted on: 22 Apr 2024
Publication: unpublished
PLUMED input files
| File | Compatible with |
|---|---|
| plumed.dat |   |
Last tested: 23 Apr 2025, 10:09:02
Project description and instructions
Provided files can be used to recreate the simulation we performed to obtain the HILLS file included. We used GROMACS 2018.6 patched with Plumed 2.5.
Submission history
[v1] 22 Apr 2024: original submission
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