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- W4312395280 endingPage "187" @default.
- W4312395280 startingPage "137" @default.
- W4312395280 abstract "The combination of in silico and in vitro approaches has proven to be useful for the pre-clinical assessment of potential drugs and novel uses for old drugs. This is frequently implemented in the case of neglected tropical diseases, where new effective and safe treatments are needed. In this chapter, we compile several in silico strategies that have been used to look for new treatments towards leishmaniasis, a parasitic disease affecting millions of people worldwide. Different computational methodologies are discussed, including molecular modeling and docking analysis, prediction of novel targets and drugs aided by bioinformatics and machine learning pipelines, ligand-based property predictions, and pharmacokinetic simulations to estimate possible drug doses based on known population data. Additional perspectives per strategy are proposed to guide researchers starting to work in the field." @default.
- W4312395280 created "2023-01-04" @default.
- W4312395280 creator A5041110319 @default.
- W4312395280 creator A5041873604 @default.
- W4312395280 creator A5053808160 @default.
- W4312395280 date "2022-01-01" @default.
- W4312395280 modified "2023-10-14" @default.
- W4312395280 title "Rational computational approaches to predict novel drug candidates against leishmaniasis" @default.
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