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100   $a20230628d2020      uy             0
101 0 $aeng
135   $aur|||||||||||
181   $ctxt$2rdacontent
182   $cc$2rdamedia
183   $acr$2rdacarrier
200 00$aCheminformatics and its Applications /$fedited by Amalia Stefaniu, Azhar Rasul, Ghulam Hussain
210  1$aLondon :$cIntechOpen,$d2020.
215   $a1 online resource (xiii, 175 pages)
311   $a1-83962-518-X 
330   $aCheminformatics has emerged as an applied branch of Chemistry that involves multidisciplinary knowledge, connecting related fields such as chemistry, computer science, biology, pharmacology, physics, and mathematical statistics.The book is organized in two sections, including multiple aspects related to advances in the development of informatic tools and their specific use in compound structure databases with various applications in life sciences, mainly in medicinal chemistry, for identification and development of new therapeutically active molecules. The book covers aspects related to genomic analysis, semantic similarity, chemometrics, pattern recognition techniques, chemical reactivity prediction, drug-likeness assessment, bioavailability, biological target recognition, machine-based drug discovery and design. Results from various computational tools and methods are discussed in the context of new compound design and development, sharing promising opportunities, and perspectives.
606   $aChemistry$xData processing
606   $aCheminformatics
615  0$aChemistry$xData processing.
615  0$aCheminformatics.
676   $a542.85
702   $aStefaniu$b Amalia
702   $aRasul$b Azhar
702   $aHussain$b Ghulam
801  0$bNjHacI
801  1$bNjHacl
906   $aBOOK
912   $a9910688215603321
996   $aCheminformatics and its Applications$92270995
997   $aUNINA