S-S bond

From: Dalhaimer, Paul Matthew (pdalhaim_at_utk.edu)
Date: Sun Feb 20 2022 - 08:06:16 CST

All,
Has anyone tried to modify the NAMD source code to allow for covalent bond formation during a simulation? Cysteine-cysteine, would be an obvious target to try this on.
-Paul

This archive was generated by hypermail 2.1.6 : Tue Dec 13 2022 - 14:32:44 CST