Matches in SemOpenAlex for { <https://semopenalex.org/work/W4200208434> ?p ?o ?g. }
Showing items 1 to 98 of
98
with 100 items per page.
- W4200208434 endingPage "2359" @default.
- W4200208434 startingPage "2359" @default.
- W4200208434 abstract "The molar refraction, polarizability, and refractive index for a series of monocarboxylic, dicarboxylic, and unsaturated monocarboxylic acids, having a symmetric or asymmetric structure, were investigated by the application of quantitative structure property relationship (QSPR) technique. We used a linear regression method and a single molecular descriptor, the ZEP topological index, calculated in a simple manner, with the help of weighted electronic distances, and also calculated on the basis of the chemical structure of the molecules. The high-quality performance and predictive ability of the QSPR models obtained were validated by means of specific validation techniques: y-randomization test, the leave-one-out cross validation procedure, and external validation. The investigated properties are well modeled (with r2 > 0.99) by the ZEP index, using the regression analysis as a statistical tool for developing reliable QSPR models. Our approach provides an alternative technique to the existing additive methods for predicting the molar refraction and polarizability of carboxylic acids, which is essentially based on the summation of atom and/or functional group contributions or bond contributions, and of some correction increments." @default.
- W4200208434 created "2021-12-31" @default.
- W4200208434 creator A5012496213 @default.
- W4200208434 date "2021-12-08" @default.
- W4200208434 modified "2023-10-16" @default.
- W4200208434 title "QSPR Models for the Molar Refraction, Polarizability and Refractive Index of Aliphatic Carboxylic Acids Using the ZEP Topological Index" @default.
- W4200208434 cites W1966518163 @default.
- W4200208434 cites W1974088956 @default.
- W4200208434 cites W1994077501 @default.
- W4200208434 cites W2009177453 @default.
- W4200208434 cites W2011580004 @default.
- W4200208434 cites W2017710425 @default.
- W4200208434 cites W2038439751 @default.
- W4200208434 cites W2041239600 @default.
- W4200208434 cites W2048312836 @default.
- W4200208434 cites W2049879885 @default.
- W4200208434 cites W2051758748 @default.
- W4200208434 cites W2073511756 @default.
- W4200208434 cites W2074681440 @default.
- W4200208434 cites W2087466582 @default.
- W4200208434 cites W2100349128 @default.
- W4200208434 cites W2106153970 @default.
- W4200208434 cites W2107114161 @default.
- W4200208434 cites W2210644715 @default.
- W4200208434 cites W2273626627 @default.
- W4200208434 cites W3164252556 @default.
- W4200208434 doi "https://doi.org/10.3390/sym13122359" @default.
- W4200208434 hasPublicationYear "2021" @default.
- W4200208434 type Work @default.
- W4200208434 citedByCount "6" @default.
- W4200208434 countsByYear W42002084342022 @default.
- W4200208434 countsByYear W42002084342023 @default.
- W4200208434 crossrefType "journal-article" @default.
- W4200208434 hasAuthorship W4200208434A5012496213 @default.
- W4200208434 hasBestOaLocation W42002084341 @default.
- W4200208434 hasConcept C105795698 @default.
- W4200208434 hasConcept C120665830 @default.
- W4200208434 hasConcept C121332964 @default.
- W4200208434 hasConcept C139287275 @default.
- W4200208434 hasConcept C147597530 @default.
- W4200208434 hasConcept C159867001 @default.
- W4200208434 hasConcept C164126121 @default.
- W4200208434 hasConcept C164923092 @default.
- W4200208434 hasConcept C178790620 @default.
- W4200208434 hasConcept C185592680 @default.
- W4200208434 hasConcept C186060115 @default.
- W4200208434 hasConcept C192562407 @default.
- W4200208434 hasConcept C205318122 @default.
- W4200208434 hasConcept C2780708107 @default.
- W4200208434 hasConcept C32909587 @default.
- W4200208434 hasConcept C33923547 @default.
- W4200208434 hasConcept C42067758 @default.
- W4200208434 hasConcept C48921125 @default.
- W4200208434 hasConcept C49040817 @default.
- W4200208434 hasConcept C71240020 @default.
- W4200208434 hasConcept C86803240 @default.
- W4200208434 hasConceptScore W4200208434C105795698 @default.
- W4200208434 hasConceptScore W4200208434C120665830 @default.
- W4200208434 hasConceptScore W4200208434C121332964 @default.
- W4200208434 hasConceptScore W4200208434C139287275 @default.
- W4200208434 hasConceptScore W4200208434C147597530 @default.
- W4200208434 hasConceptScore W4200208434C159867001 @default.
- W4200208434 hasConceptScore W4200208434C164126121 @default.
- W4200208434 hasConceptScore W4200208434C164923092 @default.
- W4200208434 hasConceptScore W4200208434C178790620 @default.
- W4200208434 hasConceptScore W4200208434C185592680 @default.
- W4200208434 hasConceptScore W4200208434C186060115 @default.
- W4200208434 hasConceptScore W4200208434C192562407 @default.
- W4200208434 hasConceptScore W4200208434C205318122 @default.
- W4200208434 hasConceptScore W4200208434C2780708107 @default.
- W4200208434 hasConceptScore W4200208434C32909587 @default.
- W4200208434 hasConceptScore W4200208434C33923547 @default.
- W4200208434 hasConceptScore W4200208434C42067758 @default.
- W4200208434 hasConceptScore W4200208434C48921125 @default.
- W4200208434 hasConceptScore W4200208434C49040817 @default.
- W4200208434 hasConceptScore W4200208434C71240020 @default.
- W4200208434 hasConceptScore W4200208434C86803240 @default.
- W4200208434 hasIssue "12" @default.
- W4200208434 hasLocation W42002084341 @default.
- W4200208434 hasLocation W42002084342 @default.
- W4200208434 hasOpenAccess W4200208434 @default.
- W4200208434 hasPrimaryLocation W42002084341 @default.
- W4200208434 hasRelatedWork W1990526620 @default.
- W4200208434 hasRelatedWork W2041149433 @default.
- W4200208434 hasRelatedWork W2060890221 @default.
- W4200208434 hasRelatedWork W2066636365 @default.
- W4200208434 hasRelatedWork W2087954428 @default.
- W4200208434 hasRelatedWork W2951754230 @default.
- W4200208434 hasRelatedWork W2955088215 @default.
- W4200208434 hasRelatedWork W3149724803 @default.
- W4200208434 hasRelatedWork W2188147464 @default.
- W4200208434 hasRelatedWork W3020889713 @default.
- W4200208434 hasVolume "13" @default.
- W4200208434 isParatext "false" @default.
- W4200208434 isRetracted "false" @default.
- W4200208434 workType "article" @default.