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buildamol
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A
support\paper_data\vs_stk\example_polymer\using_buildamol.py
 2 -
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buildamol\optimizers\__init__.py
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buildamol\optimizers\algorithms.py
87 2 3
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buildamol\optimizers\base_rotatron.py
61 2 -
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buildamol\extensions\bio\glycans\glycan.py
17 2 1
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buildamol\extensions\complexes\rotaxane_builder.py
31 2 -
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buildamol\optimizers\distance_rotatron.py
24 2 -
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buildamol\optimizers\forcefield_rotatron.py
12 2 -
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buildamol\optimizers\overlap_rotatron.py
18 2 -
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buildamol\extensions\bio\glycans\iupac.py
52 2 -
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buildamol\structural\geometry.py
159 2 -
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buildamol\__init__.py
 2 -
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buildamol\utils\xml.py
68 2 -
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buildamol\utils\abstract.py
32 2 -
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buildamol\structural\__init__.py
 2 -
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buildamol\extensions\molecular_dynamics\atom_typing\atom_typer.py
27 2 -
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buildamol\extensions\molecular_dynamics\atom_typing\charmm_typer.py
10 1 -
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buildamol\extensions\bio\nucleic_acids\__init__.py
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buildamol\extensions\molecular_dynamics\psf.py
25 1 -
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buildamol\extensions\bio\nucleic_acids\simple_sequences.py
15 1 -