NMRPredict Help
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Running a Prediction | |
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Inspecting Prediction Results | |
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C13 NMR Prediction in Detail | |
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Proton NMR Prediction in Detail |
NMRPredict Help
Overview
Logging inInitial screen
Running a prediction
Inspecting prediction results
2D Prediction display
Renumbering a structure
Saving structures, predictions and peak lists
Selecting paths
C13 NMR Prediction
C13 NMR Prediction overviewSelecting databases
Drilling down into the database
Identical structures
Selecting solvents
Text, property and structure search
Peak search
Loading or inputting a peak list
Importing ACD C13 and X-Nuclei databases
Proton NMR Prediction
BackgroundForce field calculations
Parametrised functional groups
Setting Proton Prediction options
Inspecting Proton Prediction results
Importing ACD proton databases