https://github.com/computational-nano-science-lab/functional_group_addition

The code adds functional groups to graphene surfaces
https://github.com/computational-nano-science-lab/functional_group_addition

md pdb simulation xyz

Last synced: 28 days ago
JSON representation

The code adds functional groups to graphene surfaces

• Host: GitHub
• URL: https://github.com/computational-nano-science-lab/functional_group_addition
• Owner: Computational-Nano-Science-Lab
• License: cc0-1.0
• Created: 2025-02-14T12:27:58.000Z (over 1 year ago)
• Default Branch: main
• Last Pushed: 2025-02-14T12:30:35.000Z (over 1 year ago)
• Last Synced: 2025-06-25T08:06:25.663Z (12 months ago)
• Topics: md, pdb, simulation, xyz
• Language: MATLAB
• Homepage:
• Size: 6.84 KB
• Stars: 1
• Watchers: 1
• Forks: 0
• Open Issues: 0
• Metadata Files:
  • Readme: README.md
  • License: LICENSE

Awesome Lists containing this project

README

          
# Functional_group_Addition

The code adds functional groups to graphene surfaces, provided the initial structure should be xyz/pdb format.