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PERCH NMR prediction and analysis tool

PERCH NMR prediction and analysis tool
Päiväys: 07.05.2014 10:00 - 07.05.2014 18:00
Location details: -
Kieli: english-language
lecturers: Matthias Niemitz from PERCH Solutions ltd.
Hinta: -
Lisätietoja

The course will present the capabilities and use of  PERCH NMR software by means of lectures and hands-on-tutorials. You can also bring your own spectra with you to be analysed during the course. If you would like to have some specific topics covered, please contact Matthias.

CSC provides PERCH NMR software for the Finnish academia free of charge.
Program

The main focus is on the spectral analysis of small molecules aiming on the complete assignment of all relevant NMR parameters (chemical shifts, coupling constants) required for scientific publications. This includes the corresponding PERCH tools for structure generation and molecular modeling (MMS), NMR prediction, automated consistency analysis (ACA), interactive consistency analysis and reporting.

Basic NMR knowledge is required. Prior knowledge of PERCH NMR Software is not required but the participants who want to use their own computers during the exercises should download, install and request a license for PERCH NMR Software at www.perchsolutions.com in beforehand.

Tentative Schedule

  9:45-10:00 Registration and Coffee

10:00-11:00 Introduction to PERCH NMR Software

11:00-12:00 NMR Prediction and Analysis Tools

12:00-13:00 Lunch Break

13:00-14:00 Classical Computational Spectral Analysis

14:00-14:15 Coffee break

14:15-18:00 Exercises with provided or own spectra (please make sure to bring complete data sets in Bruker or JCAMP format)