chrinide/moleview

MoleView: A Fast and lightweight plug-in for 3D molecular visualization

MoleView: A Fast and lightweight plug-in for 3D molecular visualization

Molecule + Viewer = MoleView
View your molecule anywhere and anytime!

Installation

pip install moleview

Requirements

• Python 3
• NumPy
• SciPy
• Matplotlib

Usage

moleview benzene.xyz

Gallery

Screenshots of program:

Aspirin	Alanine tripeptide	C180

Development

What you can help improve MoleView :)

• Visualization of a large molecule in matplotlib is still slow. It would be great if we can make it faster.
• Is it possible to make MoleView displays animation of a trajectory file that contains a number of structures?
• Is it possible to speed up the performance using GPU?
• It would be very great if MoleView can provide analysis functions such as molecular orbitals, density, ...

All pull requests, issues, comments and suggestions are welcome.

Support and Citation

@software{Moleview2020,
    author = "Rangsiman Ketkaew",
    title  = "MoleView: A fast and lightweight plug-in for 3D molecular visualization",
    month  = "oct",
    year   = "2020",
    url   = "https://github.com/moleview/moleview"
}

Author

Rangsiman Ketkaew : [email protected]