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Rapid optimization of the metabolic stability of an HIV-1 capsid inhibitor using a multistep computational workflow

The poor metabolic stability of the HIV-1 CA inhibitor PF-74 is a major concern in its development towards clinical use. To improve on the metabolic stability, we employed a novel multistep computationally driven workflow, which facilitated the rapid design of improved PF-74 analogs in an efficient...

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發表在:J Med Chem
Main Authors: Meuser, Megan E., Reddy, Poli Adi Narayana, Dick, Alexej, Maurancy, Jean Marc, Salvino, Joseph M., Cocklin, Simon
格式: Artigo
語言:Inglês
出版: 2021
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在線閱讀:https://ncbi.nlm.nih.gov/pmc/articles/PMC8043142/
https://ncbi.nlm.nih.gov/pubmed/33750123
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jmedchem.0c01810
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