[CP2K-user] [CP2K:17646] Regarding learning QM/MM

Md Amiruddin Hashmi hashmiempires at gmail.com
Sun Sep 11 19:34:22 UTC 2022


Dear all,

Can anyone help with learning QM/MM?
I am well versed in running all atom MD simulations and now want to learn
how to get started with QM/MM simulations for protein-ligand complexes.

Thank you!

-- 
You received this message because you are subscribed to the Google Groups "cp2k" group.
To unsubscribe from this group and stop receiving emails from it, send an email to cp2k+unsubscribe at googlegroups.com.
To view this discussion on the web visit https://groups.google.com/d/msgid/cp2k/CAKUfxh6q7PSo0cuif-Teky7Rzpg1VwCJpS5jdeFLjb99eh%3D1%3Dg%40mail.gmail.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220912/5e232b40/attachment-0001.htm>


More information about the CP2K-user mailing list