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Activity landscape image analysis using convolutional neural networks

Activity landscapes (ALs) are graphical representations that combine compound similarity and activity data. ALs are constructed for visualizing local and global structure–activity relationships (SARs) contained in compound data sets. Three-dimensional (3D) ALs are reminiscent of geographical maps wh...

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Shranjeno v:
Bibliografske podrobnosti
izdano v:J Cheminform
Main Authors: Iqbal, Javed, Vogt, Martin, Bajorath, Jürgen
Format: Artigo
Jezik:Inglês
Izdano: Springer International Publishing 2020
Teme:
Online dostop:https://ncbi.nlm.nih.gov/pmc/articles/PMC7236149/
https://ncbi.nlm.nih.gov/pubmed/33431003
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1186/s13321-020-00436-5
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