MestRes: Virtual NMR Simulator Package

Aircraft pilots use cockpit flight simulators since they are considerably less expensive to operate than actual aircraft and provide an opportunity to practice crisis problem solving without putting real people or aircraft at risk. Following the same principle, MestReS is a useful virtual NMR simulator package that was specially intended to allow students to learn and practice the NMR instrumental techniques while saving rather expensive spectrometer time and avoiding equipment damage.

Key Features:

• Real-time simulation of field locking, shimming, and acquisition


• Simulation of both continuous-wave (Bruker spectrometers) and FT (Varian spectrometers) deuterium channel


• Basic 1D processing and database creation from synthetic FID's


• Automatic import of NMR simulations from chemical drawing packages

Additional Capabilities:

• Emulation of locking and shimming effects in real-time


• Temperature variable DNMR experiments with control unit


• Advanced tool for processing capabilities (Reference Deconvolution algorithm)

By understanding how spectrometers work and how information is acquired, users can efficiently process and analyze NMR data. The license for MestReS is included with every license for MestReC, benefiting the same user.

MestReS offers a simulated environment for constructing FID's databases, emulating physical properties, and performing temperature variable DNMR experiments. Users can define spin systems and thermodynamic properties, calculate rates, and control temperature settings.

A license of MestReS allows users to gain hands-on experience with NMR instrumental techniques, enhancing their understanding and proficiency in NMR data processing.