| commit | 4239f345f25712daec281a04681b380a6f16389c | |
| author | Teemu Murtola <teemu.murtola@gmail.com> | |
| Sat, 28 Nov 2015 04:55:52 +0000 (28 06:55 +0200) | ||
| committer | Teemu Murtola <teemu.murtola@gmail.com> | |
| Sun, 10 Jan 2016 13:33:53 +0000 (10 15:33 +0200) | ||
| tree | 53f0d3c17c8d8560146a0a580d1872a5162276f9 | treesnapshot (tar.gz zip) |
| parent | 12c07b72ae96df91681320cd6312f89e864fdf8f | commitdiff |
Support frames with atom subsets in selections
- Instead of just computing the highest atom index required for
evaluating the selections, compute all the atom indices.
- Use these to check that the input frame actually contains the
necessary atoms.
- Add basic tests for one positive and a few negative cases.
Part of #1861.
Change-Id: If4c2d031f638f56d81ca4c7844dffa242f863af8
- Instead of just computing the highest atom index required for
evaluating the selections, compute all the atom indices.
- Use these to check that the input frame actually contains the
necessary atoms.
- Add basic tests for one positive and a few negative cases.
Part of #1861.
Change-Id: If4c2d031f638f56d81ca4c7844dffa242f863af8