FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2093399280> ?p ?o ?g. }

• W2093399280 endingPage "2554" @default.
• W2093399280 startingPage "2549" @default.
• W2093399280 abstract "Dechlorination of chlorinated aromatic pollutants (CAPs) has become a major issue in recent decades. This paper reported a theoretical indicator for predicting the reductive dechlorination pathways of polychlorinated dibenzo-p-dioxins (PCDDs), chlorobenzenes and chlorophenols transformed by Dehalococcoides sp. strain CBDB1. Density functional theory (DFT) calculations were carried out at the B3LYP/6-31G(d) level for all related CAPs and Mulliken atomic charges on chlorine atoms (Q(Cl(n))) were adopted as the probe of the dechlorination reaction activity. Q(Cl(n)) can consistently indicate the main dechlorination daughter products of PCDDs, chlorobenzenes and chlorophenols conducted by strain CBDB1. The dechlorination reaction favors elimination of the chlorine atoms having greater Q(Cl(n)) values. The chlorine atom with the greatest Q(Cl(n)) value tends preferentially to be eliminated, whereas the chlorine atom with the smallest Q(Cl()(n)()) value tends unlikely to be eliminated or does not react at all. For a series of compounds having similar structure, the maximal Q(Cl(n)) of each molecular can be used to predict the possibility of its daughter product(s). In addition, the difference (Q(Cl(n))) between the maximal Q(Cl(n)) and the next maximal Q(Cl(n)) of the same molecule can be used to assess the possibility of formation of multiple dechlorination products." @default.
• W2093399280 created "2016-06-24" @default.
• W2093399280 creator A5003975223 @default.
• W2093399280 creator A5014115724 @default.
• W2093399280 creator A5068376674 @default.
• W2093399280 creator A5070479705 @default.
• W2093399280 creator A5074711273 @default.
• W2093399280 creator A5091878678 @default.
• W2093399280 date "2010-05-01" @default.
• W2093399280 modified "2023-10-14" @default.
• W2093399280 title "Dechlorination pathways of diverse chlorinated aromatic pollutants conducted by Dehalococcoides sp. strain CBDB1" @default.
• W2093399280 cites W1965436979 @default.
• W2093399280 cites W1978008644 @default.
• W2093399280 cites W1984024497 @default.
• W2093399280 cites W1984381027 @default.
• W2093399280 cites W1987683406 @default.
• W2093399280 cites W1996991681 @default.
• W2093399280 cites W2000647001 @default.
• W2093399280 cites W2026243275 @default.
• W2093399280 cites W2034176955 @default.
• W2093399280 cites W2038078498 @default.
• W2093399280 cites W2046412723 @default.
• W2093399280 cites W2049862421 @default.
• W2093399280 cites W2052671685 @default.
• W2093399280 cites W2065792891 @default.
• W2093399280 cites W2077726485 @default.
• W2093399280 cites W2077877617 @default.
• W2093399280 cites W2091833072 @default.
• W2093399280 cites W2095353291 @default.
• W2093399280 cites W2098219558 @default.
• W2093399280 cites W2127734438 @default.
• W2093399280 cites W2143981217 @default.
• W2093399280 cites W2171577639 @default.
• W2093399280 doi "https://doi.org/10.1016/j.scitotenv.2010.03.003" @default.
• W2093399280 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/20346484" @default.
• W2093399280 hasPublicationYear "2010" @default.
• W2093399280 type Work @default.
• W2093399280 sameAs 2093399280 @default.
• W2093399280 citedByCount "13" @default.
• W2093399280 countsByYear W20933992802012 @default.
• W2093399280 countsByYear W20933992802014 @default.
• W2093399280 countsByYear W20933992802015 @default.
• W2093399280 countsByYear W20933992802017 @default.
• W2093399280 countsByYear W20933992802018 @default.
• W2093399280 countsByYear W20933992802019 @default.
• W2093399280 countsByYear W20933992802020 @default.
• W2093399280 countsByYear W20933992802022 @default.
• W2093399280 countsByYear W20933992802023 @default.
• W2093399280 crossrefType "journal-article" @default.
• W2093399280 hasAuthorship W2093399280A5003975223 @default.
• W2093399280 hasAuthorship W2093399280A5014115724 @default.
• W2093399280 hasAuthorship W2093399280A5068376674 @default.
• W2093399280 hasAuthorship W2093399280A5070479705 @default.
• W2093399280 hasAuthorship W2093399280A5074711273 @default.
• W2093399280 hasAuthorship W2093399280A5091878678 @default.
• W2093399280 hasConcept C107872376 @default.
• W2093399280 hasConcept C147597530 @default.
• W2093399280 hasConcept C155647269 @default.
• W2093399280 hasConcept C157021035 @default.
• W2093399280 hasConcept C15920480 @default.
• W2093399280 hasConcept C161790260 @default.
• W2093399280 hasConcept C178790620 @default.
• W2093399280 hasConcept C185592680 @default.
• W2093399280 hasConcept C2776041390 @default.
• W2093399280 hasConcept C2777166327 @default.
• W2093399280 hasConcept C2777568163 @default.
• W2093399280 hasConcept C2781460079 @default.
• W2093399280 hasConcept C2993530813 @default.
• W2093399280 hasConcept C505241676 @default.
• W2093399280 hasConcept C521977710 @default.
• W2093399280 hasConceptScore W2093399280C107872376 @default.
• W2093399280 hasConceptScore W2093399280C147597530 @default.
• W2093399280 hasConceptScore W2093399280C155647269 @default.
• W2093399280 hasConceptScore W2093399280C157021035 @default.
• W2093399280 hasConceptScore W2093399280C15920480 @default.
• W2093399280 hasConceptScore W2093399280C161790260 @default.
• W2093399280 hasConceptScore W2093399280C178790620 @default.
• W2093399280 hasConceptScore W2093399280C185592680 @default.
• W2093399280 hasConceptScore W2093399280C2776041390 @default.
• W2093399280 hasConceptScore W2093399280C2777166327 @default.
• W2093399280 hasConceptScore W2093399280C2777568163 @default.
• W2093399280 hasConceptScore W2093399280C2781460079 @default.
• W2093399280 hasConceptScore W2093399280C2993530813 @default.
• W2093399280 hasConceptScore W2093399280C505241676 @default.
• W2093399280 hasConceptScore W2093399280C521977710 @default.
• W2093399280 hasIssue "12" @default.
• W2093399280 hasLocation W20933992801 @default.
• W2093399280 hasLocation W20933992802 @default.
• W2093399280 hasOpenAccess W2093399280 @default.
• W2093399280 hasPrimaryLocation W20933992801 @default.
• W2093399280 hasRelatedWork W2038078498 @default.
• W2093399280 hasRelatedWork W2049532535 @default.
• W2093399280 hasRelatedWork W2093399280 @default.
• W2093399280 hasRelatedWork W2111624008 @default.
• W2093399280 hasRelatedWork W2375832656 @default.
• W2093399280 hasRelatedWork W2397423785 @default.
• W2093399280 hasRelatedWork W2542403856 @default.
• W2093399280 hasRelatedWork W4200312020 @default.

• next