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CCDC Virtual Workshop: ConQuest to Mercury – From Searching to Data Analysis

22 October 2024 13:00-14:45, United Kingdom


Introduction
In this workshop, you will explore a workflow to have an in-depth look at trends and behaviours of defined 3D parameters, such as inter- and intra- molecular distances, angles and torsions, and crystallographic parameters for relevant groups of structures in the CSD. The session will include presentations and demonstrations by CCDC expert tutors and a hands-on part for you to try the software, with the tutors available to help you and answer your questions.

You will learn:
- How to set up a search of the CSD using ConQuest.
- Tips and tricks on searching in ConQuest and how to define 3D parameters for further analysis.
- How to export ConQuest results to Mercury and analyse them with the Data Analysis module. 

The workshop will be recorded and all registered participants will have access to the recording.

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United Kingdom

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