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Learn how to perform basic chemistry operations with Python and RDKit. 0:00​​​​​ Intro 0:25 Project setup 0:45 The SMILES ...

... things with rd kit which is you know can be kind of confusing at times so basically you just load the filter from rdkit this predefined ...

This video explains molecular fingerprints. It shows how to generate MACCS-keys, Avalon, Atom-pair, Topological-Torsions, ...

Unleash the full potential of RDKit as you dive deep into the realm of chemoinformatics. Follow our step-by-step guide to harness ...

Ready to start your journey in cheminformatics? This beginner-friendly tutorial is your fast-track guide to setting up RDKit, the ...

Learn RDKit via systematic introduction & real projects for drug design applications, machine learning modeling, etc. Enroll now ...

Join Greg Landrum for this advanced chemistry webinar and find out how a blend of tools - RDKit, KNIME, and Python - is used ...

In this video the focus is on generating Morgan fingerprints and ECFPs using open source softwares such as python, google colab ...

Jeff hi everyone uh I'm Jeff I'm the technical lead at open force field uh and today I want to show you how to go from an rdkit ...

This tutorial deals with generating atom pair and topological torsion fingerprints using open-source cheminformatics packages.

Embark on a journey through the fascinating world of RDKit! This tutorial is your key to unlocking the power of molecular magic, ...

The video is a tutorial for generating molecular descriptors using RDKit. Link to the code: ...

This video is your complete, beginner-friendly guide to RDKit, the essential open-source cheminformatics toolkit! If you are a ...

RDKit: The Engine That Understands Molecules Every intelligent discovery system — from drug design to material innovation ...

In this video, we will be analyzing the chemical ingredients of cannabis sativa. We will be using Global-Chem to retrieve the list, ...

Calculating molecular descriptors using RDKit and Mordred. Follow the link to run this notebook in ...

Create 3D Molecular Structures in Python Using RDKit | Step-by-Step Tutorial In this video, I demonstrate how to create a 3D ...

Proposal link: https://pretalx.com/euroscipy-2023/talk/98ZVJH/ So you don't know JavaScript but know how to use python? Do you ...

Para conferir o material de aula acesse: ...