[gmx-users] spc.itp file and flexspc.itp

Anjana Jayasinghe anjusilva90 at yahoo.com
Mon Jun 4 12:13:42 CEST 2018


Dear Gromacs Users,
Is there any difference in the simulation, if we define the spc.itp as,

| #ifdef FLEX_SPC |
|  | #include "flexspc.itp" |
|  | #else |
|  | #include "spc.itp" |
|  | #endif |


instead of using the single line  #include "spc.itp" ?
Can anyone help me to understand the difference?
Thank you.







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