Basics | Solution NMR | Solid-state NMR | Structure | Screening | Metabolomics | ChemBuild | Advanced

Basics

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Beginner Data

Use these data to complete the Beginner Tutorial.

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Beginner Tutorial

Find out how to load and display spectra, change contour levels, zoom, peak pick, work with strips and print spectra.

Solution NMR

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Solution NMR Data

Spectra and projects for use with our solution NMR tutorials

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Backbone Assignment Tutorial

Find out how to do the semi-automated backbone assignment of a protein using our dedicated tools.

Screen capture from the Chemical Shift Perturbation Analysis Tutorial

Chemical Shift Perturbation Analysis Tutorial

Find out how to create a Spectrum Group for a series of spectra, copy your peak assignments between spectra, view chemical shift changes on a histogram, obtain binding curves and Kd values, and show your results on a structure in PyMol.

Solid-state NMR

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Solid-state NMR Data

Solid-state NMR spectra and projects for use with our solid-state NMR tutorials.

Screen capture from the Peptide Assignment Solid-state NMR Tutorial

Solid-state NMR Peptide Assignment Tutorial

Find out how to use Analysis to assign a small uniformly labelled peptide using 13C-detected spectra.

Screen capture from the HETs Assignment Solid-state NMR Tutorial

HETs Assignment Tutorial

Use Analysis to assign uniformly labelled HETs218 using 13C-detected spectra.

Screen capture from the Solid-state NMR Tutorial

SH3 Assignment NMR Tutorial

Learn how to AnalysisAssign to make manual assignments in solid-state NMR spectra, and assign a small protein using [1,3]-13C and [2]-13C labelled glycerol samples.

Structure

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Structure Data

Download these data to use our Structure Tutorials.

Screen capture demonstrating how to use the NMR Exchange Format (NEF) to export and deposit data

How to import NEF

Find out how to do the semi-automated backbone assignment of a protein using our dedicated tools.

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Structure Tutorial (Alpha)

Learn how to export structure calculation data to XPLOR and then import and analyse the results. You can follow this tutorial even if you don’t have XPLOR installed on your computer.

Screening

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Screen Data

Download these data and projects for use with our Screening Tutorials and How-Tos.

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Hit Analysis Tutorial

Learn how to use AnalysisScreen, including the use of SpectrumGroups, Samples, Substances, 1D peak picking, pipeline processing, hit analysis, data import from Excel and mixture generation.

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Mixtures Tutorial

Find out how to generate and analyse compound mixtures for your screening library.

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How To Create Sidebar Objects

Find out how to create SpectrumGroups, Substances and Samples in the sidebar.

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How To Import Data from Excel

Find out how to prepare an Excel file so that you can quickly import large screening datasets with thousands of reference, control mixture and target spectra.

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How To Pick 1D Peaks

Learn how to pick and manipulate 1D peaks.

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How To Run Pipelines

Use the Pipeline modules to build bespoke workflows which you can apply to large groups of spectra in one go.

Metabolomics

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Metabolomics Data

Spetra and projects which can be used to complete the Metabolomics Practicals.

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Metabolomics Practicals

A set of practicals showing you the basics of how to load, display and peak pick spectra. This is followed by instructions for how to phase spectra, use pipelines to align and re-reference them, conduct a principal component analysis (PCA) and correct baselines.

ChemBuild

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ChemBuild Tutorial & Manual

ChemBuild reference manual with short tutorials on creating short peptides, small molecule ligands and loading of SMILES.

Advanced

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Advanced Data

Spetra and projects which can be used to complete the Advanced Tutorials.

Screen capture from the Macro Writing Tutorial

Macro Writing Tutorial

Learn how easily to write Python macros in CcpNmr Analysis Version 3, so you can create shortcuts and manipulate and analyse your data in bespoke ways.