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. Author manuscript; available in PMC: 2022 Jun 28.
Published in final edited form as: J Chem Inf Model. 2021 May 25;61(6):2641–2647. doi: 10.1021/acs.jcim.1c00166

Figure 2.

Figure 2.

An example of a molecule and its compression using Method 3. 2D representation of the antiviral Remdesivir, and an illustration of the ECFP6 descriptor for Remdesivir and the compressed output.