SMILES Manager

Updated: Jul 03, 2024


Latest versions

3.0.2 for SAMSON 2024 R1

3.0.2 for SAMSON 2022 R2

3.0.2 for SAMSON 2024 R1

2936
179
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The reference price is the one in euros.

Free trial

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Monthly plans

Academic
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$16.21 / mo
Commercial
$86.94 / mo

Yearly plans

Academic
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$162.12 / year
Commercial
$869.38 / year
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SMILES Manager

Updated: Jul 03, 2024


Latest versions

3.0.2 for SAMSON 2024 R1

3.0.2 for SAMSON 2022 R2

3.0.2 for SAMSON 2024 R1

2936
179
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:

Import SMILES

Create SMILES

You can also create SMILES code from scratch:

Create SMILES

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:

Save 2D

Filter SMILES

Filter SMILES with a pattern using few clicks using the powerful search engine:

Search

Convert SMILES to 3D structures

SMILES can be easily converted to SAMSON structures by selecting them:

3D

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
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.