Gromacs  2024.2
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t_UmbrellaHeader Struct Reference
+ Collaboration diagram for t_UmbrellaHeader:


Parameters of the umbrella potentials.

Public Attributes

Using umbrella pull code since gromacs 4.x
int npullcrds
 nr of umbrella pull coordinates for reading
 the pull coordinates
gmx_bool bPrintCOM
 COMs of pull groups writtn in pullx.xvg.
gmx_bool bPrintRefValue
 Reference value for the coordinate written in pullx.xvg.
gmx_bool bPrintComp
 Components of pull distance written to pullx.xvg ?

The documentation for this struct was generated from the following file: