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1 <title>g96 file format</title>
2 <h3>Description</h3>
3 <p>A file with the g96 extension can be a GROMOS-96 initial/final
4 configuration file or a coordinate trajectory file or a combination of both.
5 The file is fixed format, all floats are written as 15.9 (files can get huge).
6 GROMACS supports the following data blocks in the given order:
7 <ul>
8 <li> Header block:
9 <ul>
10 <li><tt>TITLE</tt> (mandatory)
11 </ul>
12 <li> Frame blocks:
13 <ul>
14 <li><tt>TIMESTEP</tt> (optional)
15 <li><tt>POSITION/POSITIONRED</tt> (mandatory)
16 <li><tt>VELOCITY/VELOCITYRED</tt> (optional)
17 <li><tt>BOX</tt> (optional)
18 </ul>
19 </ul>
20 See the GROMOS-96 manual for a complete description of the blocks.
21 <p>
22 Note that all GROMACS programs can read compressed or g-zipped files.