Gromacs
2024.4
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Essential dynamics vectors per method implementation.
Public Attributes | |
t_eigvec | mon = {} |
only monitored, no constraints | |
t_eigvec | linfix = {} |
fixed linear constraints | |
t_eigvec | linacc = {} |
acceptance linear constraints | |
t_eigvec | radfix = {} |
fixed radial constraints (exp) | |
t_eigvec | radacc = {} |
acceptance radial constraints (exp) | |
t_eigvec | radcon = {} |
acceptance rad. contraction constr. | |