Dear all, I'm currently studying the structural changes and thermodynamic properties of a protein structure when binding the ligand. Here I have ran the MD run for 50 ns and calculate the SASA value from the gromacs 5.1.2 version. According to my knowledge I got only the total SASA value. But I want to get the hydrophobic and hydrophilic SASA values seperately from the gromacs 5.1.2 version as well. Therefore would you please help me to solve this problem. Thanks in advance. -- Gromacs Users mailing list
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