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22 Commits 1 Branch 0 Tags
208a51acfe407a47c8d74768d3e8a2e05915eeab
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9 Commits

Author SHA1 Message Date
Niels Müller
208a51acfe Catch some possible seg faults when opening invalid xtc files. 2016-06-06 16:59:16 +02:00
Niels Müller
98757efe13 Implemnted xtcindex file handling for XTCReader. 2016-06-06 13:57:19 +02:00
Niels Müller
8d3d09fcc9 Ignore Cython c files. 2016-06-03 13:06:56 +02:00
Niels Müller
a601636d55 Moved gromacs module from mdevaluate to pygmx 2016-06-03 12:34:36 +02:00
Niels Müller
eeb5c607f8 Remove enxio for now. 2016-06-02 13:51:51 +02:00
Niels Müller
ff92b01e3e Reduce verbosity when reading tpr files. 2016-04-23 19:13:39 +02:00
Niels Müller
56c38cb46b Bundle commit of all recent changes on pygmx. 2016-03-30 11:52:02 +02:00
Niels Müller
21e6594c07 Use gromacs 5.1 release (instead of master) 2016-03-16 14:54:53 +01:00
Niels Müller
58d5d3a6c4 First draft of a python wrapper for gromacs library 2016-03-16 13:07:02 +01:00
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