Computer-assisted structure elucidation

Computer-assisted structure elucidation (or CASE) is the technique of using software to generate all possible molecular structures that are consistent with a particular set of spectroscopic data.The subject has been often reviewed.[1][2] Available CASE software include LSD,[3][4] SENECA,[5] COCON,[6][7] CMC-se,[8] and Structure Elucidator.[9]

See also

References


🔥 Top keywords: Main PageShannen DohertySpecial:SearchCarlos AlcarazList of United States presidential assassination attempts and plotsAttempted assassination of Donald TrumpDonald TrumpRichard Simmons2024 shooting at a Donald Trump rallyLamine YamalNovak DjokovicNico WilliamsUEFA European ChampionshipWikipedia:Featured picturesThomas Matthew CrooksProject 2025Attempted assassination of Ronald ReaganUEFA Euro 2024Jacoby JonesAR-15–style rifleMukesh AmbaniLonglegsSpain national football teamKimberly CheatleKalki 2898 ADList of Wimbledon gentlemen's singles championsCole PalmerGareth SouthgateJohn Hinckley Jr.Harry KaneLuke PerryAntifa (United States)United States Secret Service.xxxDeaths in 2024Ruth WestheimerEvan VucciButler, PennsylvaniaIndian 2