Import thousands of SMILES codes. Filter them using custom patterns. Modify them and generate their corresponding 2D image. Add them to the SAMSON Document with a single click. And much more!
Documentation
You can find more information in the following tutorials:
Below is a very brief overview of some of the main functionalities.
Import SMILES
This extension allows you to directly import SMILES from a file:
Create SMILES
You can also create SMILES code from scratch:
Generate 2D depictions from SMILES
2D conformation of each code is generated on the fly. PNG or SVG images of this 2D conformations can be saved at any time:
Filter SMILES
Filter SMILES with a pattern using few clicks using the powerful search engine:
Convert SMILES to 3D structures
SMILES can be easily converted to SAMSON structures by selecting them:
SMILES Manager is an extension for SAMSON,
the integrative platform for molecular design.
To use SMILES Manager:
1. Create your free account
and choose a molecular design plan
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2. Download
and install SAMSON on your computer
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3. Come back to this page to add the extension to
your account
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When you restart SAMSON, the extension will be automatically installed
and will be usable directly from within SAMSON.