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__init__(self,
proteins,
covalent_ligand_asl=None,
receptor_residue_asl=None)
Takes a list of protein cts, and asl's indicating the covalent ligand
in the proteins |
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dump_raw_ligands(self,
file_name)
More for debugging |
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set_indices(self,
asl,
ct)
Will set the atom indices |
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generate_ligands(self,
neighbor=0)
Will generate new ct's from covalent ligand fragemnts in protein. |
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| create_ligand(self,
ct,
idx) |
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Inherited from object:
__delattr__,
__format__,
__getattribute__,
__hash__,
__new__,
__reduce__,
__reduce_ex__,
__repr__,
__setattr__,
__sizeof__,
__str__,
__subclasshook__
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