Commit Graph

220 Commits

Author SHA1 Message Date
fd2b5b1cd8 switch completed section from EXPECT to ASSERT 2020-07-14 12:45:54 -04:00
d6e6b840e9 update body/nparticle tester 2020-07-14 11:06:06 -04:00
18928c6602 start writing tester for body/nparticle 2020-07-14 08:11:18 -04:00
ea1d447703 fix bug in tester for atom style tri 2020-07-13 21:49:18 -04:00
00413ae956 add test for atom style tri 2020-07-12 16:32:59 -04:00
8f95b4a5d9 add tests for deleted bonds and angles to bond/angle tests suites 2020-07-12 15:48:21 -04:00
a28db101cc add checks for atom style bond with newton off. add basic test for atom style angle 2020-07-10 17:44:05 -04:00
a402de41b7 finalize atom style tester changes 2020-07-10 10:47:30 -04:00
772d75a63a update tester for renaming reset_ids to reset_atom_ids 2020-07-10 10:29:55 -04:00
df63d4147d Merge branch 'reset-molecules' into write-bonus-data 2020-07-10 10:25:08 -04:00
8102045fdb add initial implementation for atom style bond tester 2020-07-10 10:24:54 -04:00
ab683a03ad start tester for atom style hybrid full ellipsoid 2020-07-10 00:12:57 -04:00
f0af7c686a more death tests to reach 100% coverage 2020-07-09 21:39:55 -04:00
d15264a668 update and expand tester code for reset_mol_ids changes 2020-07-09 21:18:58 -04:00
f71513f483 update for atom style ellipsoid tester 2020-07-09 11:56:07 -04:00
cc9df9a76d add test module for atom style line 2020-07-09 11:55:52 -04:00
4da8ec39de complete testing ellipsoids short of having restart support. 2020-07-08 21:13:28 -04:00
5918d9e6c7 avoid googletest stalling on exit tests when using OpenMPI 2020-07-08 16:31:36 -04:00
d6665aba99 refactor tester 2020-07-08 10:08:00 -04:00
c0f1472385 use parenthesis to correct precedence 2020-07-07 21:21:32 -04:00
416467a154 update reset_mol_ids tests for the latest changes 2020-07-07 17:14:54 -04:00
94e9b3bc82 rename reset_ids command to reset_atom_ids 2020-07-07 13:32:00 -04:00
7e140399db add (initial) testing for ellipsoid atom style 2020-07-07 12:36:17 -04:00
169206790a small tweak 2020-07-07 10:29:43 -04:00
2351f99bef add (incomplete) tester for reset_mol_ids (with a little use of reset_ids, too) 2020-07-06 21:26:11 -04:00
d37e943e8d refactor tester 2020-07-06 14:12:50 -04:00
9e96b71703 Merge pull request #2214 from akohlmey/kspace-tests
Add unit tests for some kspace styles and more pair styles
2020-07-06 12:48:09 -04:00
9ec72d1406 add tests for unknown commands, quit, and reset_timestep 2020-07-06 10:26:04 -04:00
461633e6f6 add unit tests for the suffix, thermo, and timestep commands 2020-07-06 00:11:13 -04:00
e2a07acb71 add test for units command 2020-07-05 13:20:23 -04:00
ca24cd5006 simplify tests for failures with a varyadic macro 2020-07-05 12:48:52 -04:00
69052fa337 add test for lj/mdf 2020-07-05 00:28:02 -04:00
4dee43cc2d adjust accepted relative error for compiler optimization, make pppm/disp inputs 3x faster 2020-07-05 00:10:47 -04:00
84ded03e24 add tests for some core-shell package pair styles 2020-07-04 23:43:15 -04:00
585466929f add tests for pppm/disp/tip4p and lj/long/tip4p/long 2020-07-04 23:21:57 -04:00
a314b40aa0 skip testing broken pppm/disp/intel style 2020-07-04 23:07:50 -04:00
6e580bbdb5 add tests for long-range dispersion styles 2020-07-04 22:55:59 -04:00
2eec6c7f65 exclude MSM tests when compiling with single precision 2020-07-04 18:26:00 -04:00
0461599d0a reduce base precision as required when running tests with pppm and FFT_SINGLE 2020-07-04 18:13:55 -04:00
df40ffddf3 add some more tests for pair styles 2020-07-04 17:24:28 -04:00
ffe8e1c0e9 add tests for kspace styles using the pair style tester tool 2020-07-04 17:22:27 -04:00
fcec94579c skip tests for single and extract when testing kspace styles (and pair styles are disabled) 2020-07-04 17:21:51 -04:00
75977367a1 fix memory leak 2020-07-04 17:21:19 -04:00
2c64809cd8 enlarge buffer for guessed file name 2020-07-02 23:35:25 -04:00
0b298c7193 add tests for supported and unsupported unit conversion when opening potentials 2020-07-02 23:07:01 -04:00
d331e75a14 tweak test name 2020-07-02 22:39:08 -04:00
3a014a5430 add unit tests for some file operations 2020-07-02 14:50:56 -04:00
a524eaf424 add a few more tests 2020-07-02 10:27:35 -04:00
c3fe0e77c2 expose guesspath function and add unit test 2020-07-02 09:13:57 -04:00
c7a31aea97 force environment variable 2020-07-01 09:39:47 -04:00