ChemShell
@chemshell.bsky.social
ChemShell is a computational chemistry environment for multiscale QM/MM modelling developed at STFC Daresbury Laboratory and collaborating groups around the world.
Website: chemshell.org
Website: chemshell.org
Py-ChemShell is suitable for production calculations on all types of chemical systems and we recommend that new ChemShell users use the Python-based version.
The code is open source and can be downloaded free of charge from our website. For more info see: chemshell.org/py-chemshell...
The code is open source and can be downloaded free of charge from our website. For more info see: chemshell.org/py-chemshell...
Py-ChemShell 2025 released - ChemShell
We are delighted to announce the release of Py-ChemShell 2025 (v25.0), the latest release of the Python-based version of ChemShell.
chemshell.org
October 7, 2025 at 12:27 PM
Py-ChemShell is suitable for production calculations on all types of chemical systems and we recommend that new ChemShell users use the Python-based version.
The code is open source and can be downloaded free of charge from our website. For more info see: chemshell.org/py-chemshell...
The code is open source and can be downloaded free of charge from our website. For more info see: chemshell.org/py-chemshell...
A collaboration with @scihans.bsky.social , @mikehough.bsky.social , @adrianmulholla1.bsky.social , and many others not yet on Bluesky!
September 24, 2025 at 1:10 PM
A collaboration with @scihans.bsky.social , @mikehough.bsky.social , @adrianmulholla1.bsky.social , and many others not yet on Bluesky!
Hi Marwin, thanks for compiling this and could you add our account too please?
November 25, 2024 at 5:16 PM
Hi Marwin, thanks for compiling this and could you add our account too please?