Project ID: plumID:21.042
Name: Peptoid-mediated Au nanocrystal growth
Archive: https://github.com/xinqiz/peptoid_au/raw/main/Peptoid_Au.zip
Category: materials
Keywords: parallel-bias metadynamics, peptoid, Au
PLUMED version: 2.4
Contributor: Xin Qi
Submitted on: 20 Oct 2021
Publication: B. Jin, F. Yan, X. Qi, B. Cai, J. Tao, X. Fu, S. Tan, P. Zhang, J. Pfaendtner, N. Y. Naser, F. Baneyx, X. Zhang, J. J. DeYoreo, C. Chen, Peptoid‐Directed Formation of Five‐Fold Twinned Au Nanostars through Particle Attachment and Facet Stabilization. Angewandte Chemie. 134 (2022)
PLUMED input files
| File | Compatible with |
|---|---|
| Plumed_nest/plumed_Nce3Ncp6_Au100.dat |   |
| Plumed_nest/plumed_Nce3Ncp6_Au111.dat | |
| Plumed_nest/plumed_Nce6Ncp6_Au100.dat | |
| Plumed_nest/plumed_Nce6Ncp6_Au111.dat | |
Last tested: 22 Apr 2025, 10:09:24
Project description and instructions
These files can be used with GROMACS 5.1 and PLUMED 2.4 to reproduce the results.
Click here to open manual pages for actions used in this project.
Submission history
[v1] 20 Oct 2021: original submission
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