Modeling of molecular properties /

"Molecular modeling encompasses applied theoretical approaches and computational techniques to model structures and properties of molecular compounds and materials in order to predict and / or interpret their properties. The modeling covered in this book ranges from methods for small chemical t...

Πλήρης περιγραφή

Λεπτομέρειες βιβλιογραφικής εγγραφής
Άλλοι συγγραφείς: Comba, Peter
Μορφή: Ηλ. βιβλίο
Γλώσσα:English
Έκδοση: Weinheim : Wiley-VCH, [2011]
Θέματα:
Διαθέσιμο Online:Full Text via HEAL-Link
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035 |a (OCoLC)773106765  |z (OCoLC)808597157  |z (OCoLC)961535843  |z (OCoLC)962593709 
037 |a 10.1002/9783527636402  |b Wiley InterScience  |n http://www3.interscience.wiley.com 
050 4 |a QD480  |b .M64 2011eb 
060 4 |a 2011 C-446 
060 4 |a QD 480 
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082 0 4 |a 620.11299  |2 23 
049 |a MAIN 
245 0 0 |a Modeling of molecular properties /  |c edited by Peter Comba. 
264 1 |a Weinheim :  |b Wiley-VCH,  |c [2011] 
264 4 |c ©2011 
300 |a 1 online resource (xxv, 485 pages) :  |b illustrations 
336 |a text  |b txt  |2 rdacontent 
337 |a computer  |b c  |2 rdamedia 
338 |a online resource  |b cr  |2 rdacarrier 
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380 |a Bibliography 
504 |a Includes bibliographical references (pages 466-468) and index. 
520 |a "Molecular modeling encompasses applied theoretical approaches and computational techniques to model structures and properties of molecular compounds and materials in order to predict and / or interpret their properties. The modeling covered in this book ranges from methods for small chemical to large biological molecules and materials. With its comprehensive coverage of important research fields in molecular and materials science, this is a must-have for all organic, inorganic and biochemists as well as materials scientists interested in applied theoretical and computational chemistry. The 28 chapters, written by an international group of experienced theoretically oriented chemists, are grouped into four parts: Theory and Concepts; Applications in Homogeneous Catalysis; Applications in Pharmaceutical and Biological Chemistry; and Applications in Main Group, Organic and Organometallic Chemistry. The various chapters include concept papers, tutorials, and research reports."--  |c Provided by publisher. 
588 0 |a Print version record. 
650 0 |a Molecules  |x Models. 
650 0 |a Biochemistry. 
650 0 |a Chemistry, Organic. 
650 0 |a Chemistry, Inorganic. 
650 7 |a SCIENCE  |x Nanoscience.  |2 bisacsh 
650 7 |a Biochemistry.  |2 fast  |0 (OCoLC)fst00831961 
650 7 |a Chemistry, Inorganic.  |2 fast  |0 (OCoLC)fst00853488 
650 7 |a Chemistry, Organic.  |2 fast  |0 (OCoLC)fst00853501 
650 7 |a Molecules  |x Models.  |2 fast  |0 (OCoLC)fst01024878 
655 4 |a Electronic books. 
700 1 |a Comba, Peter. 
776 0 8 |i Print version:  |t Modeling of molecular properties.  |d Weinheim : Wiley-VCH, ©2011  |z 9783527330218  |w (OCoLC)756277708 
856 4 0 |u https://doi.org/10.1002/9783527636402  |z Full Text via HEAL-Link 
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