Shortcut: PDB2CONSTANT
| Module | generic |
|---|---|
| Description | Usage |
| Create a constant value from a PDB input file |   |
| output value | type |
| a value that is constructed from the information in the PDB file | scalar/vector/matrix |
Input
The arguments that serve as the input for this action are specified using one or more of the keywords in the following table.
| Keyword | Type | Description |
|---|---|---|
| ARG | scalar/vector | read this single argument from the input rather than the atomic structure |
Further details and examples
Text from manual goes here
Syntax
The following table describes the keywords and options that can be used with this action
| Keyword | Type | Default | Description |
|---|---|---|---|
| ARG | input | none | read this single argument from the input rather than the atomic structure |
| REFERENCE | compulsory | none | a file in pdb format containing the reference structure |
| NUMBER | compulsory | 0 | if there are multiple structures in the pdb file you can specify that you want the RMSD from a specific structure by specifying its place in the file here |
| NOARGS | optional | false | the arguments that are being read from the PDB file are not in the plumed input |