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faac18ffd2
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add tester tool for timestep related fixes: integrators, thermostats, force manipulations, constraints
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2020-08-08 22:54:17 -04:00 |
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9c3d108bbc
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enable aligning consecutive assignments
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2020-06-13 02:05:13 -04:00 |
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3db944decc
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apply clang-format settings to the c++ sources in the unittest tree
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2020-06-13 01:54:58 -04:00 |
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1042e16423
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change format for equilibrium values and update writer and reader code, so it will become compatible with class2 angles/dihedrals/impropers
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2020-05-30 17:50:38 -04:00 |
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99c0c1ace1
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simplify parsing of equilibrium data
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2020-05-29 08:22:34 -04:00 |
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7d62fd5106
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remove debug code
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2020-05-29 08:22:23 -04:00 |
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797ba373c4
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simplify reading key/value pairs from string
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2020-05-28 22:38:23 -04:00 |
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47e4da4903
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add support for writing/reading equilibrium bond/angle data
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2020-05-28 22:20:43 -04:00 |
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5533b9233f
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Fix indentation
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2020-05-20 02:48:02 -04:00 |
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ad6ae7317e
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Use std::make_pair
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2020-05-20 02:45:16 -04:00 |
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73e766b933
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Remove another unneeded class
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2020-05-20 01:30:34 -04:00 |
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50d4cf210c
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Remove unnecessary classes
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2020-05-19 23:37:11 -04:00 |
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c04a71a239
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add unit test framework for pair, bond, angle styles from progguide branch
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2020-05-19 22:24:31 -04:00 |
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