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nomad-lab
nomad-meta-info
Commits
8ec558a1
Commit
8ec558a1
authored
Jan 24, 2018
by
Berk Onat
Browse files
Added missing meta info names for Gromacs.
parent
59d1b04a
Changes
1
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meta_info/nomad_meta_info/gromacs.nomadmetainfo.json
View file @
8ec558a1
...
...
@@ -2078,6 +2078,24 @@
"section_run"
,
"x_gromacs_section_control_parameters"
]
},
{
"description"
:
"Gromacs running environment and control parameters."
,
"name"
:
"x_gromacs_inout_control_energygrpflags1"
,
"dtypeStr"
:
"C"
,
"shape"
:
[],
"superNames"
:
[
"section_run"
,
"x_gromacs_section_control_parameters"
]
},
{
"description"
:
"Gromacs running environment and control parameters."
,
"name"
:
"x_gromacs_inout_control_energygrpflags2"
,
"dtypeStr"
:
"C"
,
"shape"
:
[],
"superNames"
:
[
"section_run"
,
"x_gromacs_section_control_parameters"
]
},
{
"name"
:
"x_gromacs_section_atom_to_atom_type_ref"
,
"kindStr"
:
"type_section"
,
...
...
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