Real-time collaboration in StarDrop 8
See how StarDrop integrates powerful real-time collaboration into every stage of the molecule design and optimisation workflow. This ensures your…
In this example, we will use the Sensitivity Analysis tool in StarDrop’s MPO Explorer module to check if the ranking of compounds in a data set is sensitive to any of the criteria or importance values in a scoring profile.
This is important to consider because, if the compounds we would choose are very sensitive to a property criterion, we should carefully consider if this criterion is appropriate to avoid missing potentially valuable opportunities.
This analysis can also help to determine if different values for a criterion would have an impact on the strategy for a project, for example if there is a disagreement regarding the most appropriate criterion to use. If the ranking of compounds is essentially unchanged within a reasonable range of values, this means that the scoring profile can be used with confidence that the ultimate selection will be robust to the chosen criteria.
To try this example yourself, download the example project file and follow the step-by-step guidelines.
Please note that the tutorial explores core features of StarDrop and the MPO Explorer module. If you don’t have access to StarDrop and would like to arrange a trial, please email us at info@optibrium.com
See how StarDrop integrates powerful real-time collaboration into every stage of the molecule design and optimisation workflow. This ensures your…
Version This script is for the latest version of StarDrop for either Windows or Mac. To find out which version you have…
This StarDrop script estimates free fraction (fᵤ) in microsomes, hepatocytes, and plasma from experimental data in other media, experimental logD…