Cargando…

Machine learning in chemistry : the impact of artificial intelligence /

This book provides practical examples of machine learning applied to science to help researchers make an informed choice about using the method in chemistry.

Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Cartwright, Hugh M., 1948- (Editor )
Formato: Electrónico eBook
Idioma:Inglés
Publicado: London : Royal Society of Chemistry, 2020.
Colección:Theoretical and computational chemistry ; 17.
Temas:
Acceso en línea:Texto completo

MARC

LEADER 00000cam a2200000 i 4500
001 KNOVEL_on1179002329
003 OCoLC
005 20231027140348.0
006 m o d
007 cr cnu---unuuu
008 200729s2020 enk ob 001 0 eng d
040 |a UKRSC  |b eng  |e rda  |e pn  |c UKRSC  |d N$T  |d YDX  |d EBLCP  |d UKAHL  |d YDXIT  |d UKMGB  |d OCLCF  |d OCLCQ  |d AFU  |d MFS  |d OCLCO  |d AAA  |d OCLCO  |d OCLCQ  |d K6U  |d OCLCQ 
015 |a GBC085899  |2 bnb 
016 7 |a 019842780  |2 Uk 
019 |a 1190850717 
020 |a 9781839160233  |q (electronic book) 
020 |a 1839160233  |q (electronic book) 
020 |a 9781839160240  |q (electronic book) 
020 |a 1839160241  |q (electronic book) 
020 |z 9781788017893 
020 |z 1788017897 
029 1 |a AU@  |b 000067663984 
029 1 |a UKMGB  |b 019842780 
029 1 |a AU@  |b 000074000482 
035 |a (OCoLC)1179002329  |z (OCoLC)1190850717 
037 |a 5840:5684  |b Royal Society of Chemistry  |n http://www.rsc.org/spr 
050 4 |a QD39.3.E46  |b M33 2020 
082 0 4 |a 542.85631  |2 23 
049 |a UAMI 
245 0 0 |a Machine learning in chemistry :  |b the impact of artificial intelligence /  |c edited by Hugh M. Cartwright. 
264 1 |a London :  |b Royal Society of Chemistry,  |c 2020. 
300 |a 1 online resource 
336 |a text  |b txt  |2 rdacontent 
337 |a computer  |b c  |2 rdamedia 
338 |a online resource  |b cr  |2 rdacarrier 
490 1 |a Theoretical and computational chemistry ;  |v 17 
504 |a Includes bibliographical references and index. 
505 0 |a Computers as scientists -- How do machines learn? -- MedChemInformatics: an introduction to machine learning for drug discovery -- Machine learning for nonadiabatic molecular dynamics -- Machine learning in science-a role for mechanic sympathy? -- A prediction of future states: AI-powered chemical innovation for defense applications -- Machine learning for chemical synthesis -- Constraining chemical networks in astrochemistry -- Machine learning at he (nano)materials-biology interface -- Machine learning techniques applied to a complex polymerization process -- machine learning and scoring functions (SFs) for molecular drug discovery: prediction and characterisation of druggable drugs and targets -- Artificial intelligence applied to the prediction of organic materials -- A new era of inorganic materials discovery powered by data science -- Machine learning application sin chemical engineering -- representation learning in chemistry -- Demystifying artificial neural networks as generators of new chemical knowledge: antimalarial drug discovery as a case study -- Machine learning for core-loss spectrum -- Autonomous science: big data tools for small data problems in chemistry -- Machine learning for heterogeneous catalysis: global neural network potential from construction to applications -- A few guiding principles for practical applications of machine learning to chemistry and materials. 
520 |a This book provides practical examples of machine learning applied to science to help researchers make an informed choice about using the method in chemistry. 
588 0 |a Online resource; title from digital title page (viewed on September 24, 2020). 
590 |a Knovel  |b ACADEMIC - Chemistry & Chemical Engineering 
650 0 |a Chemistry  |x Data processing. 
650 0 |a Machine learning. 
650 2 |a Cheminformatics 
650 6 |a Chimio-informatique. 
650 6 |a Apprentissage automatique. 
650 7 |a Chemistry  |x Data processing  |2 fast  |0 (OCoLC)fst00853366 
650 7 |a Machine learning  |2 fast  |0 (OCoLC)fst01004795 
700 1 |a Cartwright, Hugh M.,  |d 1948-  |e editor. 
776 0 8 |i Print version:  |t Machine learning in chemistry.  |d Cambridge : Royal Society of Chemistry, 2020  |z 9781788017893  |w (OCoLC)1173575313 
830 0 |a Theoretical and computational chemistry ;  |v 17. 
856 4 0 |u https://appknovel.uam.elogim.com/kn/resources/kpMLCTIAI1/toc  |z Texto completo 
938 |a Askews and Holts Library Services  |b ASKH  |n AH36936703 
938 |a ProQuest Ebook Central  |b EBLB  |n EBL6317305 
938 |a EBSCOhost  |b EBSC  |n 2577126 
938 |a YBP Library Services  |b YANK  |n 16907766 
994 |a 92  |b IZTAP