Hi Guys,
I have done the simulation. The total steps is 500. At around 90 steps,
the error information appear like the followings.
Please give me some suggestions to fix it.
Best wishes,
Desheng
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Program mdrun, VERSION 4.5.5
On 4/26/12 2:52 PM, Desheng Zheng wrote:
Hi Guys,
I have done the simulation. The total steps is 500. At around 90 steps,
the error information appear like the followings.
Please give me some suggestions to fix it.
Based on the comment that precedes the error call in the code:
On 4/26/12 3:30 PM, Desheng Zheng wrote:
Thanks Justin!
about the Software inconsistency error: Inconsistent DD boundary staggering
limits!
I still have three concerts.
1. Is it ok, if i use grompp to generate the edr file in gromacs 4.5.5
environmentwith the gro file and top file which
] help about Inconsistent DD boundary staggering
limits
On 4/26/12 2:52 PM, Desheng Zheng wrote:
Hi Guys,
I have done the simulation. The total steps is 500. At around 90
steps, the error information appear like the followings.
Please give me some suggestions to fix
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