NMR Metabolomics — Acquisition, Processing & Annotation — Hands-on

Develop a complete, practice ready workflow for NMR based metabolomics. This module walks you from basic 1H NMR concepts and experiment setup through acquisition, spectra processing, bucketing or peak picking, and metabolite annotation using curated spectral libraries and databases for robust quantitative and qualitative readouts.

NMR Metabolomics — Acquisition, Processing & Annotation

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Session Index

Session 1 — NMR Basics, Experiments & Metabolomics Context Session 2 — Acquisition Parameters & QC for NMR Runs Session 3 — Spectral Processing & Data Reduction Session 4 — Metabolite Annotation & Reporting

Session 1

Fee: Rs 8800

NMR Basics, Experiments & Metabolomics Context

Principles of NMR for metabolomics applications

chemical shift & spin systems relaxation & line width sensitivity & dynamic range

1H NMR experiments commonly used in metabolomics

1D proton CPMG / T2 filter (overview) NOESY presat / water suppression

Matrices, sample tubes and basic preparation for NMR

biofluids (plasma, serum, urine) buffers & pH control deuterated solvents & references

Session 2

Fee: Rs 11800

Acquisition Parameters & QC for NMR Runs

Setting up NMR acquisition for metabolomics

spectral width & offset number of scans & relaxation delay temperature control

Shimming, locking, tuning and water suppression checks

lock optimization manual vs automated shimming water peak management

Run QC and system suitability for NMR metabolomics

reference compounds reproducibility metrics instrument drift awareness

Session 3

Fee: Rs 14800

Spectral Processing & Data Reduction

Core processing steps from FID to spectrum

zero filling & apodization Fourier transform phase & baseline correction

Alignment, reference and solvent region handling

chemical shift referencing alignment approaches (overview) water and urea region treatment

Data reduction: binning vs peak picking strategies

fixed width and adaptive binning peak lists export to multivariate tools

Session 4

Fee: Rs 18800

Metabolite Annotation & Reporting

Annotation workflows with spectral libraries and databases

HMDB / BMRB (concepts) in house libraries confidence levels

Relative and absolute quantitation considerations in NMR

integrals vs peak heights internal standards dilution and linearity checks

Deliverables: processed dataset, annotation table & methods note

bucket / feature matrix (CSV) metabolite annotation sheet NMR metabolomics methods summary

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NMR Metabolomics — Acquisition, Processing & Annotation Training | Spectral Workflows & Annotation

NMR Metabolomics — Acquisition, Processing & Annotation — Hands-on