Resources: Chemical Space Docking®

Content

Helpful guides on how to get Chemical Space Docking® (C-S-D) running and get the most out of it.

C-S-D Starter Package (features ROCK1 Test Space)

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HPSee Deployment Guide

HPSee Deployment Guide

Need help setting up HPSee as your instance for computation?
The Deployment Guide focuses on installation and setup for HPSee, covering single-node (Docker Compose) and multi-node (Swarm/cluster) deployments, license configuration, and admin dashboard operations.
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Good Practice Guide

We have compiled a set of best practice recommendations to help SeeSAR and Chemical Space Docking® (C-S-D) users achieve optimal and rewarding results.

You can also access a web version of the PDF following this link.
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Step-by-Step Video Guide:
SeeSAR 14 Atlas - Hello Chemical Space Docking® - Access the world of Chemical Spaces!

Introducing SeeSAR 14 Atlas – the next generation tool for screening ultra-vast Chemical Spaces using C-S-D! In this video, we’ll walk you through how C-S-D allows you to efficiently explore vast molecular universes and discover potential drug candidates faster than ever before. Learn how to to unlock molecular diversity while using only a fraction of the computational resources required by traditional methods. Plus, we’ll dive into other exciting features.

Discover how SeeSAR 14 Atlas opens up new possibilities for drug discovery, including partnerships with AMBrosia, CHEMriya, eXplore, and Enamine’s REAL Space. Dive into new chemical territories and enhance your workflow with SeeSAR 14's innovative tools!
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SeeSAR Beginner's Guide

SeeSAR Beginner's Guide

A guide for the basics on how to operate SeeSAR. Also features a step-by-step Chemical Space Docking® tutorial.
Additionally, you can learn how to operate the drug design dashboard to perform tasks such as docking, molecule editing, and compound ideation with the Inspirator Mode.
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Recordings