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Example: Automatic QSAR model building and validation

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May 29, 2024
7:26

In this instance, we delve into utilizing the Auto-Modeller module for constructing a QSAR model, focusing on the potency against the Muscarinic Acetylcholine M5 receptor, leveraging publicly available Ki data. The model thus generated is then employed to forecast the properties of novel compounds and visualize the SAR. If you'd like to learn more about about how you can use StarDrop to help your drug discovery projects or request a demo, please visit our website: https://bit.ly/3NxUh2l

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Example: Automatic QSAR model building and validation | NatokHD