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buildamol
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A
docs\requirements.txt
 1 -
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buildamol\structural\patch.py
57 1 -
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support\tools\add_example_gallery.py
6 1 -
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support\paper_data\vs_stk\example_macrocycle\using_stk.py
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buildamol\extensions\polymers\nanotubes.py
6 1 -
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buildamol\extensions\molecular_dynamics\atom_typing\charmm_typer.py
10 1 -
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buildamol\structural\connector.py
20 1 1
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buildamol\structural\geometry.py
159 2 -
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buildamol\extensions\molecular_dynamics\solvate\__init__.py
1 2 -
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buildamol\structural\neighbors.py
117 2 2
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buildamol\extensions\polymers\polycarbons.py
25 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\extensions\molecular_factories\__init__.py
 2 -
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support\paper_data\vs_stk\example_cyclohept_amine_NCore\using_buildamol.py
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buildamol\graphs\__init__.py
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buildamol\extensions\bio\glycans\glycan.py
17 2 1
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buildamol\optimizers\__init__.py
 2 -
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buildamol\optimizers\algorithms.py
87 2 3
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buildamol\extensions\complexes\rotaxane_builder.py
31 2 -