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module | colvar_methods |
| defines collective variables s({R}) and the derivative of this variable wrt R these can then be used in constraints, restraints and metadynamics ...
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recursive subroutine, public | colvar_methods::colvar_read (colvar, icol, colvar_section, para_env) |
| reads a colvar from the input More...
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subroutine, public | colvar_methods::colvar_eval_mol_f (colvar, cell, particles, pos, fixd_list) |
| evaluates the derivatives (dsdr) given and due to the given colvar variables in a molecular environment More...
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subroutine, public | colvar_methods::colvar_eval_glob_f (icolvar, force_env) |
| evaluates the derivatives (dsdr) given and due to the given colvar More...
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