Action: TEMPLATE
| Module | colvar |
|---|---|
| Description | Usage |
| This file provides a template for if you want to introduce a new CV. |   |
| output value | type |
| a description of the value that is computed by this colvar should be included here | scalar |
Input
The atoms that serve as the input for this action are specified using one or more of the keywords in the following table.
| Keyword | Type | Description |
|---|---|---|
| ATOMS | atoms | the keyword with which you specify what atoms to use should be added like this |
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 |
|---|---|---|---|
| ATOMS | input | none | the keyword with which you specify what atoms to use should be added like this |
| TEMPLATE_COMPULSORY | compulsory | none | all compulsory keywords should be added like this with a description here |
| NUMERICAL_DERIVATIVES | optional | false | calculate the derivatives for these quantities numerically |
| NOPBC | optional | false | ignore the periodic boundary conditions when calculating distances |
| TEMPLATE_DEFAULT_OFF_FLAG | optional | false | flags that are by default not performed should be specified like this |
| TEMPLATE_OPTIONAL | optional | not used | all optional keywords that have input should be added like a description here |