Gromacs
2018.8
|
Parameters of one pull coodinate.
Public Attributes | |
int | pull_type |
such as constraint, umbrella, ... | |
int | geometry |
such as distance, direction, cylinder | |
int | ngroup |
the number of pull groups involved | |
ivec | dim |
pull dimension with geometry distance | |
int | ndim |
nr of pull_dim != 0 | |
real | k |
force constants in tpr file | |
real | init_dist |
reference displacement | |
char | coord_unit [256] |
unit of the displacement | |