Basics | Solution NMR | Solid-state NMR | Structure | Screening | Metabolomics | ChemBuild | New Version 3.1 Tutorials
Basics
Beginner Data
Use these data to complete the Beginner Tutorial.
Beginner Tutorial
Find out how to load and display spectra, change contour levels, zoom, peak pick, work with strips and print spectra.
Solution NMR
Solution NMR Data
Spectra and projects for use with our solution NMR tutorials
Backbone Assignment Tutorial
Find out how to do the semi-automated backbone assignment of a protein using our dedicated tools.
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
Solid-state NMR Data
Solid-state NMR spectra and projects for use with our solid-state NMR tutorials.
Solid-state NMR Peptide Assignment Tutorial
Find out how to use Analysis to assign a small uniformly labelled peptide using 13C-detected spectra.
HETs Assignment Tutorial
Use Analysis to assign uniformly labelled HETs218 using 13C-detected spectra.
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
Structure Data
Download these data to use our Structure Tutorials.
How to import NEF
Find out how to do the semi-automated backbone assignment of a protein using our dedicated tools.
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
Screen Data
Download these data and projects for use with our Screening Tutorials and How-Tos.
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.
Mixtures Tutorial
Find out how to generate and analyse compound mixtures for your screening library.
How To Create Sidebar Objects
Find out how to create SpectrumGroups, Substances and Samples in the sidebar.
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.
How To Pick 1D Peaks
Learn how to pick and manipulate 1D peaks.
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
Metabolomics Data
Spetra and projects which can be used to complete the Metabolomics Practicals.
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
ChemBuild Tutorial & Manual
ChemBuild reference manual with short tutorials on creating short peptides, small molecule ligands and loading of SMILES.
