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MODELLER command reference
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energy_data.energy_terms user-defined
Contents
Index
The
io_data
class: coordinate file input parameters
The
io_data
class stores information useful in reading coordinate files. This is used both for reading models, and for reading coordinate files used for templates.
Subsections
io_data() — create a new input parameters object
io_data.hetatm — whether to read HETATM records
io_data.hydrogen — whether to read hydrogen atoms
io_data.water — whether to read water molecules
io_data.convert_modres — whether to convert modified residues
io_data.atom_files_directory — search path for coordinate files
