Atoms Selector

Updated: September 20, 2023


Latest versions

4.0.0 for SAMSON 2023 R1

4.0.0 for SAMSON 2023 R1

4.0.0 for SAMSON 2023 R1

1255
419

Free extension

Free
No credit card required

Atoms Selector

Updated: September 20, 2023


Latest versions

4.0.0 for SAMSON 2023 R1

4.0.0 for SAMSON 2023 R1

4.0.0 for SAMSON 2023 R1

1255
419
Select atoms based on expressions with NSL-like variables, standard mathematical and logical operations.

This extension allows selecting atoms based on expressions with the usage of NSL-like variables (NSL - Node Specification Language), standard mathematical and logical operations.

Example: cut a cylinder with radius 10Å out of quartz crystal

Documentation

Please, refer to the Simple Script tutorial for more information, an example for the Atoms Selector is placed in the end of the tutorial.

References

Parsing and evaluation of expressions is done thanks to the C++ Mathematical Expression Parsing And Evaluation Library exprtk by Arash Partow.

Atoms Selector is an extension for SAMSON,
the integrative platform for molecular design.

To use Atoms Selector:

1. Create your free account and choose a molecular design plan
2. Download and install SAMSON on your computer
3. Come back to this page to add the extension to your account


When you restart SAMSON, the extension will be automatically installed
and will be usable directly from within SAMSON.

Related extensions

Discovering Alkanes