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Feature #2056

rename "gmx select"

Added by Chris Neale almost 4 years ago.

Status:
New
Priority:
Low
Assignee:
-
Category:
-
Target version:
-
Difficulty:
simple
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Description

"select" is a bash flow control command. Adding the command "gmx select ..." in front of a bash for loop makes vim bash highlighting think the done statement is incorrectly placed. Not an actual error, but it does complicate script debugging. One could imagine similar complications with tools like "gmx done" or "gmx if"

Suggest rename the select tool to gmx selection or gmx selector or something else

Associated revisions

Revision 298f4798 (diff)
Added by Eric Irrgang 11 months ago

Improve sample_restraint project integration.

Build for testing as part of a gmxapi enabled GROMACS build. Fix some
errors and collisions.

  • Use distinct CMake options for using bundled pybind sources in
    gmxapi Python package and sample_restraint package.
  • Distinguish between "umbrella" build and standalone build when
    trying to determine googletest source for sample_restraint.
  • Avoid a couple of warnings about unused variables.
  • Use GTest::Main target more consistently for sample_restraint tests.

Refs #2056
Refs #3027
Refs #3033

Change-Id: I55d20e6228779ecc726587231c83298356192f6f

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