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Combining Charge Density Analysis with Machine Learning Tools To Investigate the Cruzain Inhibition Mechanism
[Image: see text] Trypanosoma cruzi, a flagellate protozoan parasite, is responsible for Chagas disease. The parasite major cysteine protease, cruzain (Cz), plays a vital role at every stage of its life cycle and the active-site region of the enzyme, similar to those of other members of the papain s...
Autores principales: | , , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2019
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6881835/ https://www.ncbi.nlm.nih.gov/pubmed/31788588 http://dx.doi.org/10.1021/acsomega.9b01934 |