Gromacs
2022.2
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Parameters of one pull coordinate.
Public Attributes | |
PullingAlgorithm | pull_type |
such as constraint, umbrella, ... | |
PullGroupGeometry | 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 | |