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Issues with python plotting graphs
Hello,
After running chap and selecting water to analyze, I created the free energy profile, hydrophobicity profile, radius profile and solvent number density profile graphs from here: https://www.channotation.org/docs/plotting_python/
The free energy profile and radius profile graphs look realistic.
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The hydrophobicity profile graph is a straight line at 0. There are no dots on the graph to show the hydrophobicity profile. Do you know why the hydrophobicities are not being read?
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The solvent number density profile graph for water contains consistent density around ~5-10 nm^-3. However, the pore being analyzed is huge (3-4 nm wide) so I would assume there is a free passage of water through the pore, and that the density should be closer to free water density (~33 nm^-3). Do you know why the solvent density would be lower than free water? Is this realistic?
Thanks for your help!