Matches in SemOpenAlex for { <https://semopenalex.org/work/W2150974312> ?p ?o ?g. }
Showing items 1 to 100 of
100
with 100 items per page.
- W2150974312 endingPage "145" @default.
- W2150974312 startingPage "129" @default.
- W2150974312 abstract "Abstract d -Glucopyranose and d -galactopyranose, in their α and β forms, together with some of their mono- and di-substituted parent molecules, were investigated theoretically in order to evaluate the solvent effect on the differential stability of various regions of the potential surfaces. In particular, the aim of this study was to evaluate the solvent effect on the conformational stabilities and the possibility of wide oscillations and/or correlated motions of exocyclic groups in the presence of water. Energies of molecules in aqueous solution were calculated by the polarizable continuum model in conjunction with the semiempirical AM1 method. Water as solvent favours the anti conformation of the exocyclic hydroxyl groups (except the anomeric one), mostly reduces the oscillation amplitude, and lowers the barriers to the rotation of the hydroxymethyl group. Concerted motions of exocyclic groups imply barriers which are somewhat higher, especially in galactose." @default.
- W2150974312 created "2016-06-24" @default.
- W2150974312 creator A5044522791 @default.
- W2150974312 creator A5060177485 @default.
- W2150974312 date "1995-08-01" @default.
- W2150974312 modified "2023-09-26" @default.
- W2150974312 title "A theoretical study of d-glucose, d-galactose, and parent molecules: solvent effect on conformational stabilities and rotational motions of exocyclic groups" @default.
- W2150974312 cites W1973932243 @default.
- W2150974312 cites W1975084378 @default.
- W2150974312 cites W1976243383 @default.
- W2150974312 cites W1977177721 @default.
- W2150974312 cites W1982434151 @default.
- W2150974312 cites W1984550252 @default.
- W2150974312 cites W1984900762 @default.
- W2150974312 cites W1985681892 @default.
- W2150974312 cites W1991297990 @default.
- W2150974312 cites W1991334453 @default.
- W2150974312 cites W1994489143 @default.
- W2150974312 cites W2007464721 @default.
- W2150974312 cites W2010191774 @default.
- W2150974312 cites W2016320348 @default.
- W2150974312 cites W2028819452 @default.
- W2150974312 cites W2032211023 @default.
- W2150974312 cites W2034450643 @default.
- W2150974312 cites W2035575107 @default.
- W2150974312 cites W2039468536 @default.
- W2150974312 cites W2041748978 @default.
- W2150974312 cites W2044335990 @default.
- W2150974312 cites W2045470600 @default.
- W2150974312 cites W2058805983 @default.
- W2150974312 cites W2059968265 @default.
- W2150974312 cites W2061433500 @default.
- W2150974312 cites W2061897814 @default.
- W2150974312 cites W2067373045 @default.
- W2150974312 cites W2077973224 @default.
- W2150974312 cites W2080563218 @default.
- W2150974312 cites W2086261577 @default.
- W2150974312 cites W2087249133 @default.
- W2150974312 cites W2095474273 @default.
- W2150974312 cites W2100874326 @default.
- W2150974312 cites W2102112101 @default.
- W2150974312 cites W2108293193 @default.
- W2150974312 cites W2137364876 @default.
- W2150974312 cites W2139973281 @default.
- W2150974312 cites W2149469850 @default.
- W2150974312 cites W2163076362 @default.
- W2150974312 cites W2169655552 @default.
- W2150974312 cites W2312758621 @default.
- W2150974312 cites W2317861136 @default.
- W2150974312 cites W2327551031 @default.
- W2150974312 cites W3025623913 @default.
- W2150974312 doi "https://doi.org/10.1016/0008-6215(95)00109-7" @default.
- W2150974312 hasPublicationYear "1995" @default.
- W2150974312 type Work @default.
- W2150974312 sameAs 2150974312 @default.
- W2150974312 citedByCount "26" @default.
- W2150974312 countsByYear W21509743122012 @default.
- W2150974312 countsByYear W21509743122014 @default.
- W2150974312 countsByYear W21509743122017 @default.
- W2150974312 countsByYear W21509743122022 @default.
- W2150974312 crossrefType "journal-article" @default.
- W2150974312 hasAuthorship W2150974312A5044522791 @default.
- W2150974312 hasAuthorship W2150974312A5060177485 @default.
- W2150974312 hasConcept C132439834 @default.
- W2150974312 hasConcept C147597530 @default.
- W2150974312 hasConcept C178790620 @default.
- W2150974312 hasConcept C185592680 @default.
- W2150974312 hasConcept C2778173381 @default.
- W2150974312 hasConcept C2780471494 @default.
- W2150974312 hasConcept C32909587 @default.
- W2150974312 hasConcept C71240020 @default.
- W2150974312 hasConceptScore W2150974312C132439834 @default.
- W2150974312 hasConceptScore W2150974312C147597530 @default.
- W2150974312 hasConceptScore W2150974312C178790620 @default.
- W2150974312 hasConceptScore W2150974312C185592680 @default.
- W2150974312 hasConceptScore W2150974312C2778173381 @default.
- W2150974312 hasConceptScore W2150974312C2780471494 @default.
- W2150974312 hasConceptScore W2150974312C32909587 @default.
- W2150974312 hasConceptScore W2150974312C71240020 @default.
- W2150974312 hasIssue "2" @default.
- W2150974312 hasLocation W21509743121 @default.
- W2150974312 hasOpenAccess W2150974312 @default.
- W2150974312 hasPrimaryLocation W21509743121 @default.
- W2150974312 hasRelatedWork W2036417085 @default.
- W2150974312 hasRelatedWork W2047687409 @default.
- W2150974312 hasRelatedWork W2064608078 @default.
- W2150974312 hasRelatedWork W2064798175 @default.
- W2150974312 hasRelatedWork W2087622689 @default.
- W2150974312 hasRelatedWork W2089919114 @default.
- W2150974312 hasRelatedWork W2189329264 @default.
- W2150974312 hasRelatedWork W2473515915 @default.
- W2150974312 hasRelatedWork W2805315383 @default.
- W2150974312 hasRelatedWork W2950541071 @default.
- W2150974312 hasVolume "273" @default.
- W2150974312 isParatext "false" @default.
- W2150974312 isRetracted "false" @default.
- W2150974312 magId "2150974312" @default.
- W2150974312 workType "article" @default.