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GROMACS PROBLEM
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DD cell 2 2 0 could only obtain 1256 of the 1262 atoms that are connected via constraints from the neighboring cells. This probably means your constraint lengths are too long compared to the domain decomposition cell size. Decrease the number of domain decomposition grid cells or lincs-order. MDRUN的时候出现了此问题，希望小木虫的大神帮助下。 |
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