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What do you want to calculate?
Association rate constants
Dissociation rate constants or residence times
Binding or unbinding pathways
Pharmacokinetic/pharmacodynamic properties
Association rate constants
Do you have existing kinetic data for a number of similar complexes, with which you can train a model?
Yes, I have training data
No, I do not have training data
No, I do not have training data
Do you have structural data to define the complex formed by the binding partners?
Yes, I have structural data
No, I do not have any structural data
No, I do not have any structural data
Do you need to obtain absolute data values, or are relative values sufficient?
Absolute data is required
Relative values are sufficient
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