FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W3207919348> ?p ?o ?g. }

• W3207919348 endingPage "11716" @default.
• W3207919348 startingPage "11709" @default.
• W3207919348 abstract "We present a model to explain the mechanism behind enantiomeric separation under either shear flow or local rotational motion in a fluid. Local vorticity of the fluid imparts molecular rotation that couples to translational motion, sending enantiomers in opposite directions. Translation-rotation coupling of enantiomers is explored using the molecular hydrodynamic resistance tensor, and a molecular equivalent of the pitch of a screw is introduced to describe the degree of translation-rotation coupling. Molecular pitch is a structural feature of the molecules and can be easily computed, allowing rapid estimation of the pitch of 85 druglike molecules. Simulations of model enantiomers in a range of fluids such as Λ- and Δ-[Ru(bpy)3]Cl2 in water and (R, R)- and (S, S)-atorvastatin in methanol support predictions made using molecular pitch values. A competition model and continuum drift-diffusion equations are developed to predict separation of realistic racemic mixtures. We find that enantiomeric separation on a centimeter length scale can be achieved in hours, using experimentally achievable vorticities. Additionally, we find that certain achiral objects can also exhibit a nonzero molecular pitch." @default.
• W3207919348 created "2021-10-25" @default.
• W3207919348 creator A5018502317 @default.
• W3207919348 creator A5049074187 @default.
• W3207919348 date "2021-10-15" @default.
• W3207919348 modified "2023-10-13" @default.
• W3207919348 title "Separation of Enantiomers through Local Vorticity: A Screw Model Mechanism" @default.
• W3207919348 cites W1456292401 @default.
• W3207919348 cites W1488460573 @default.
• W3207919348 cites W1964895229 @default.
• W3207919348 cites W1979864973 @default.
• W3207919348 cites W1988443151 @default.
• W3207919348 cites W1995736252 @default.
• W3207919348 cites W1998977288 @default.
• W3207919348 cites W2004566760 @default.
• W3207919348 cites W2010766162 @default.
• W3207919348 cites W2014475368 @default.
• W3207919348 cites W2021581224 @default.
• W3207919348 cites W2022045967 @default.
• W3207919348 cites W2035492259 @default.
• W3207919348 cites W2046058559 @default.
• W3207919348 cites W2049475242 @default.
• W3207919348 cites W2077625362 @default.
• W3207919348 cites W2107606823 @default.
• W3207919348 cites W2111459061 @default.
• W3207919348 cites W2126363023 @default.
• W3207919348 cites W2127056376 @default.
• W3207919348 cites W2261886039 @default.
• W3207919348 cites W2323456326 @default.
• W3207919348 cites W2483901436 @default.
• W3207919348 cites W2497268282 @default.
• W3207919348 cites W2531882311 @default.
• W3207919348 cites W2806479814 @default.
• W3207919348 cites W2947838884 @default.
• W3207919348 cites W2962926965 @default.
• W3207919348 doi "https://doi.org/10.1021/acs.jpcb.1c07127" @default.
• W3207919348 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/34652162" @default.
• W3207919348 hasPublicationYear "2021" @default.
• W3207919348 type Work @default.
• W3207919348 sameAs 3207919348 @default.
• W3207919348 citedByCount "4" @default.
• W3207919348 countsByYear W32079193482022 @default.
• W3207919348 countsByYear W32079193482023 @default.
• W3207919348 crossrefType "journal-article" @default.
• W3207919348 hasAuthorship W3207919348A5018502317 @default.
• W3207919348 hasAuthorship W3207919348A5049074187 @default.
• W3207919348 hasBestOaLocation W32079193482 @default.
• W3207919348 hasConcept C121332964 @default.
• W3207919348 hasConcept C131584629 @default.
• W3207919348 hasConcept C140820882 @default.
• W3207919348 hasConcept C147597530 @default.
• W3207919348 hasConcept C185592680 @default.
• W3207919348 hasConcept C191897082 @default.
• W3207919348 hasConcept C192562407 @default.
• W3207919348 hasConcept C200114574 @default.
• W3207919348 hasConcept C2524010 @default.
• W3207919348 hasConcept C33923547 @default.
• W3207919348 hasConcept C486523 @default.
• W3207919348 hasConcept C57879066 @default.
• W3207919348 hasConcept C59593255 @default.
• W3207919348 hasConcept C71240020 @default.
• W3207919348 hasConcept C74050887 @default.
• W3207919348 hasConceptScore W3207919348C121332964 @default.
• W3207919348 hasConceptScore W3207919348C131584629 @default.
• W3207919348 hasConceptScore W3207919348C140820882 @default.
• W3207919348 hasConceptScore W3207919348C147597530 @default.
• W3207919348 hasConceptScore W3207919348C185592680 @default.
• W3207919348 hasConceptScore W3207919348C191897082 @default.
• W3207919348 hasConceptScore W3207919348C192562407 @default.
• W3207919348 hasConceptScore W3207919348C200114574 @default.
• W3207919348 hasConceptScore W3207919348C2524010 @default.
• W3207919348 hasConceptScore W3207919348C33923547 @default.
• W3207919348 hasConceptScore W3207919348C486523 @default.
• W3207919348 hasConceptScore W3207919348C57879066 @default.
• W3207919348 hasConceptScore W3207919348C59593255 @default.
• W3207919348 hasConceptScore W3207919348C71240020 @default.
• W3207919348 hasConceptScore W3207919348C74050887 @default.
• W3207919348 hasFunder F4320337393 @default.
• W3207919348 hasIssue "42" @default.
• W3207919348 hasLocation W32079193481 @default.
• W3207919348 hasLocation W32079193482 @default.
• W3207919348 hasLocation W32079193483 @default.
• W3207919348 hasOpenAccess W3207919348 @default.
• W3207919348 hasPrimaryLocation W32079193481 @default.
• W3207919348 hasRelatedWork W2001693313 @default.
• W3207919348 hasRelatedWork W2039718172 @default.
• W3207919348 hasRelatedWork W2142712358 @default.
• W3207919348 hasRelatedWork W2253660660 @default.
• W3207919348 hasRelatedWork W2951355420 @default.
• W3207919348 hasRelatedWork W3104850968 @default.
• W3207919348 hasRelatedWork W3136846573 @default.
• W3207919348 hasRelatedWork W4297778873 @default.
• W3207919348 hasRelatedWork W4379466911 @default.
• W3207919348 hasRelatedWork W2487473869 @default.
• W3207919348 hasVolume "125" @default.
• W3207919348 isParatext "false" @default.
• W3207919348 isRetracted "false" @default.
• W3207919348 magId "3207919348" @default.

• next