[gmx-users] SASA calculation in Gromacs

Pandya, Akash akash.pandya.15 at ucl.ac.uk
Tue Nov 26 12:31:01 CET 2019


Hi all,

I calculated the SASA on a per residue basis using the flag -or and I have values ranging from 0 to 1.88 nm2 . My question is how can I determine the thresholds between buried/exposed residues? I did a literature search, but was unable to find any literature. Any guidance would be much appreciated.


Best wishes,

Akash


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