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READMEH A D30-Sep-2021528 1310

__init__.pyH A D30-Sep-202157 21

io_binary.pyH A D30-Sep-20211.5 KiB4835

io_pdb.pyH A D30-Sep-20215.6 KiB174135

io_xml.pyH A D30-Sep-202115.6 KiB521376

io_xyz.pyH A D30-Sep-20214.6 KiB146110

README

1 -- IO functions directory --
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3 * This is the directory containing input/output functions.
4
5 * Files:
6   - io_binary.py: Contains the functions to write output in binary format.
7   - io_pdb.py: Contains the functions to read pdb structure files and to
8      create pdb trajectory output files.
9   - io_xml.py: Contains the functions used to read the xml input file and
10      to format the restart output file.
11   - io_xyz.py: Contains the functions to read xyz structure files and to
12      create xyz trajectory output files.
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