[gmx-users] hydrophobic interactions

Andrew Bostick andrew.bostick1 at gmail.com
Fri Dec 28 13:32:13 CET 2018


Dear Sudip,

Thanks for answer. gmx sasa gives data such as area vs time, area vs
residue and area vs atom. But I want to have the number of hydrophobic
interaction between protein and ligand during the trajectory and get those
residues took part in this type of interactions.

Best,
Andrew


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