Computer aided drug design, its success and limitation

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dc.contributor.authorAnsari, Nikhat
dc.contributor.authorBengal, Gajanan Bhujangrao (17PH05)
dc.contributor.authorDabir, Safa Rafique (17PH07)
dc.contributor.authorKArbari, Tuba Salim (17PH16)
dc.contributor.authorSayyed, Gufran Ali Meer Ajagar Ali (17PH42)
dc.date.accessioned2021-11-12T05:40:09Z
dc.date.available2021-11-12T05:40:09Z
dc.date.issued2020-05
dc.description.abstractModerndrugdiscoveryischaracterizedbytheproductionofvastquantitiesofcompoundsand theneedtoexaminethesehugelibrariesinshortperiodsoftime Theneedtostore,manageandanalyzetheserapidlyincreasingresourceshasgivenrisetothe fieldknownascomputer-aideddrugdesign(CADD). CADDrepresentscomputationalmethodsandresourcesthatareusedtofacilitatethedesign anddiscoveryofnewtherapeuticsolutions. Digitalrepositories,containingdetailedinformationondrugsandotherusefulcompounds,are goldminesfortheStudyofchemicalreactionscapabilities.Designlibraries,withthepotentialto generatemolecularvariantsintheirentirety,allowtheselectionandsamplingofchemical compoundswithdiversecharacteristics. Structure-baseddrugdesignandligand-baseddrugdesign aretwomethodscommonlyusedincomputer-aideddrugdesign.Inthisarticle,wediscussthe theorybehindbothmethods,aswellas theirsuccessfulapplicationsandlimitations.en_US
dc.identifier.urihttp://localhost:8080/xmlui/handle/123456789/3685
dc.language.isoenen_US
dc.publisherAIKTCen_US
dc.subjectProject Report - SoPen_US
dc.titleComputer aided drug design, its success and limitationen_US
dc.typeProject Reporten_US
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