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GROMACS raised error code 1! <- unclear #37

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punkpony opened this issue Jul 3, 2023 · 0 comments
Open

GROMACS raised error code 1! <- unclear #37

punkpony opened this issue Jul 3, 2023 · 0 comments
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punkpony commented Jul 3, 2023

not clear what is happening - defaults to [n] not sure how to trace back:

Saving solvated box with ions as 'SWa-1_7_5_solv_ions'

Centering clay in box

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                                         Minimising energy                                          
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GROMACS raised error code 1!

Print error message? [y]es/[n]o (default no)
[1]  + 65424 suspended (tty input)  ClayCode builder -f SWa1.yaml
(base) ~/D/H/C/Tutorial ❯❯❯
@punkpony punkpony added the bug Something isn't working label Jul 3, 2023
@punkpony punkpony changed the title GROMACS raised error code 1! - unclear GROMACS raised error code 1! <- unclear Jul 4, 2023
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