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Editing residue list #11
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As already mentioned: there must be a feature to add custom residues and their properties. |
maxscheurer
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Editing hbond atoms and residue list
Editing residue list
Apr 20, 2017
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Currently, we are reading atom types/names from a CHARMM parameter file,probably we can make a default list in the GUI and let the user add or change new atom types/names
or even better: make a recognition scheme for types of atoms, as not all the users will have CHARMM topologies... While I'm writing this, I am thinking that the atom types stuff in the hbond recognition is really stupid and we should think of a better solution... Sorry, I will self-assign me to this task.
Furthermore, there must be a feature to add custom residues and their properties.
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