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Measuring and Calculating Objects in Mercury (2020.3)
A self-guided workshop on how to measure distances, angles, and torsions and how to calculate centroids and planes in Mercury.
Last Modified: 03/06/2021 PDF
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Full Interaction Maps (2020.3)
A self-guided workshop on how to generate and interpret full interaction maps.
Last Modified: 12/01/2021 PDF
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Intermolecular interaction searching in ConQuest
A self-guided workshop on how to include inter- and intra-molecular interactions in ConQuest searches.
Last Modified: 18/09/2020 PDF
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Using 3D information in searches in ConQuest
A self-guided workshop on advanced searching in ConQuest
Last Modified: 16/09/2020 PDF
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Introduction to ConQuest
A self-guided workshop on how to conduct basic search in ConQuest
Last Modified: 16/09/2020 PDF
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CSD-CrossMiner Tutorial 4 (2020.3)
Self-guided workshop: Using CSD-CrossMiner to Create a Feature Database
Last Modified: 07/07/2020 PDF
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CSD-CrossMiner Tutorial 3 (2020.3)
Self-guided workshop: Creating a Pharmacophore Query from a Reference Molecule & Scaffold Hopping in CSD-CrossMiner
Last Modified: 07/07/2020 PDF
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Pose Prediction with GOLD Tutorial (2020)
Last Modified: 07/07/2020 PDF
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Pharmacophore Constraints with GOLD Tutorial (2020)
Last Modified: 07/07/2020 PDF
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Flexibility and Constraints in GOLD Tutorial (2020)
Last Modified: 07/07/2020 PDF