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a0a865643e
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add missing coefficiencts to data file. no more need to set afterwards
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2021-02-24 20:42:25 -05:00 |
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cf9255a90d
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avoid problems testing dihedrals and impropers
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2021-02-24 18:37:58 -05:00 |
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c6b6369d2d
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fix bug in input script templates that would have the timestep setting overwritten by a units command
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2020-09-15 09:46:57 -04:00 |
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b1e9b6d3fc
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set variable for checking thermostat target temperature
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2020-08-09 01:33:37 -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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