Matches in SemOpenAlex for { <https://semopenalex.org/work/W4379403775> ?p ?o ?g. }
- W4379403775 endingPage "262" @default.
- W4379403775 startingPage "239" @default.
- W4379403775 abstract "Drug development is challenging for the pharmaceutical sector, as it is time-consuming and cost extensive to complete all the phases necessary to transform a chemical into a new drug. Recently, the exploitation of computational approaches in the early stages of drug discovery has risen. Structure-based virtual screening (SBVS) has evolved into a potent method critical to success at the lead identification stage of the drug discovery pipeline since pharmaceutical companies and academic research divisions extensively use it. The chapter revealed how SBVS is used to find compounds that could be considered bioactive hits in the campaigns of lead discovery, which include homology modeling, molecular docking, molecular dynamics (MD) simulation, databases, and virtual screening (VS) approaches. These tools are crucial in the statistical machine learning (ML) techniques that can be applied in various stages of the drug development process to organize and analyze massive data sets. We also covered the methodologies and algorithms currently available for SBVS. Conclusively, based on the outcomes of previous methodological research, we make recommendations for future prospective SBVS studies." @default.
- W4379403775 created "2023-06-06" @default.
- W4379403775 creator A5002422673 @default.
- W4379403775 creator A5020492148 @default.
- W4379403775 creator A5028093046 @default.
- W4379403775 creator A5062403817 @default.
- W4379403775 creator A5086001605 @default.
- W4379403775 date "2023-01-01" @default.
- W4379403775 modified "2023-10-13" @default.
- W4379403775 title "Structure-based virtual screening" @default.
- W4379403775 cites W1586243412 @default.
- W4379403775 cites W1606231443 @default.
- W4379403775 cites W1822985148 @default.
- W4379403775 cites W1950993160 @default.
- W4379403775 cites W1968947646 @default.
- W4379403775 cites W1969231606 @default.
- W4379403775 cites W1971570097 @default.
- W4379403775 cites W1973974137 @default.
- W4379403775 cites W1975071709 @default.
- W4379403775 cites W1975447903 @default.
- W4379403775 cites W1979641354 @default.
- W4379403775 cites W1980872595 @default.
- W4379403775 cites W1985588649 @default.
- W4379403775 cites W1989897116 @default.
- W4379403775 cites W1991548368 @default.
- W4379403775 cites W2000040483 @default.
- W4379403775 cites W2003236427 @default.
- W4379403775 cites W2003356525 @default.
- W4379403775 cites W2005817231 @default.
- W4379403775 cites W2009064762 @default.
- W4379403775 cites W2011570309 @default.
- W4379403775 cites W2021312899 @default.
- W4379403775 cites W2033428036 @default.
- W4379403775 cites W2034475831 @default.
- W4379403775 cites W2035395192 @default.
- W4379403775 cites W2037320975 @default.
- W4379403775 cites W2038561883 @default.
- W4379403775 cites W2043764521 @default.
- W4379403775 cites W2047647552 @default.
- W4379403775 cites W2052030759 @default.
- W4379403775 cites W2053099416 @default.
- W4379403775 cites W2053449148 @default.
- W4379403775 cites W2053658752 @default.
- W4379403775 cites W2053861881 @default.
- W4379403775 cites W2062845058 @default.
- W4379403775 cites W2066962978 @default.
- W4379403775 cites W2070040136 @default.
- W4379403775 cites W2076966462 @default.
- W4379403775 cites W2080948893 @default.
- W4379403775 cites W2085732173 @default.
- W4379403775 cites W2092820537 @default.
- W4379403775 cites W2096864392 @default.
- W4379403775 cites W2101220662 @default.
- W4379403775 cites W2106612397 @default.
- W4379403775 cites W2114520383 @default.
- W4379403775 cites W2117526623 @default.
- W4379403775 cites W2118587156 @default.
- W4379403775 cites W2118958548 @default.
- W4379403775 cites W2129253766 @default.
- W4379403775 cites W2129438079 @default.
- W4379403775 cites W2135484509 @default.
- W4379403775 cites W2140611297 @default.
- W4379403775 cites W2146984355 @default.
- W4379403775 cites W2147330086 @default.
- W4379403775 cites W2149007706 @default.
- W4379403775 cites W2152630148 @default.
- W4379403775 cites W2156053468 @default.
- W4379403775 cites W2158534713 @default.
- W4379403775 cites W2158714788 @default.
- W4379403775 cites W2159675211 @default.
- W4379403775 cites W2160205549 @default.
- W4379403775 cites W2167901867 @default.
- W4379403775 cites W2168577803 @default.
- W4379403775 cites W2171030481 @default.
- W4379403775 cites W2176516200 @default.
- W4379403775 cites W2177317049 @default.
- W4379403775 cites W2208203352 @default.
- W4379403775 cites W2221330345 @default.
- W4379403775 cites W2261525379 @default.
- W4379403775 cites W2271736303 @default.
- W4379403775 cites W2524453358 @default.
- W4379403775 cites W2558999090 @default.
- W4379403775 cites W2606882994 @default.
- W4379403775 cites W2739254607 @default.
- W4379403775 cites W2767891136 @default.
- W4379403775 cites W2897805491 @default.
- W4379403775 cites W2900569176 @default.
- W4379403775 cites W2950389803 @default.
- W4379403775 cites W2959938226 @default.
- W4379403775 cites W2971976902 @default.
- W4379403775 cites W2990099866 @default.
- W4379403775 cites W2991090734 @default.
- W4379403775 cites W2997160604 @default.
- W4379403775 cites W3003785226 @default.
- W4379403775 cites W3007309629 @default.
- W4379403775 cites W3020257619 @default.
- W4379403775 cites W3025378907 @default.
- W4379403775 cites W3027308092 @default.