000 02675cam a2200277zu 4500
001 88832028
003 FRCYB88832028
005 20250107213855.0
006 m o d
007 cr un
008 250107s2016 fr | o|||||0|0|||eng d
020 _a9781681080536
035 _aFRCYB88832028
040 _aFR-PaCSA
_ben
_c
_erda
100 1 _aBasak, Subhash C.
245 0 1 _aAdvances in Mathematical Chemistry and Applications: Volume 2
_c['Basak, Subhash C.']
264 1 _bElsevier Science
_c2016
300 _a p.
336 _btxt
_2rdacontent
337 _bc
_2rdamdedia
338 _bc
_2rdacarrier
650 0 _a
700 0 _aBasak, Subhash C.
856 4 0 _2Cyberlibris
_uhttps://international.scholarvox.com/netsen/book/88832028
_qtext/html
_a
520 _aAdvances in Mathematical Chemistry and Applications highlights the recent progress in the emerging discipline of discrete mathematical chemistry. Editors Subhash C. Basak, Guillermo Restrepo, and Jose Luis Villaveces have brought together 27 chapters written by 68 internationally renowned experts in these two volumes. Each volume comprises a wise integration of mathematical and chemical concepts and covers numerous applications in the field of drug discovery, bioinformatics, chemoinformatics, computational biology, mathematical proteomics, and ecotoxicology. Volume 2 explores deeper the topics introduced in Volume 1, with numerous additional topics such as topological approaches for classifying fullerene isomers; chemical reaction networks; discrimination of small molecules using topological molecular descriptors; GRANCH methods for the mathematical characterization of DNA, RNA and protein sequences; linear regression methods and Bayesian techniques; in silico toxicity prediction methods; drug design; integration of bioinformatics and systems biology, molecular docking, and molecular dynamics; metalloenzyme models; protein folding models; molecular periodicity; generalized topologies and their applications; and many more.Brings together both the theoretical and practical aspects of the fundamental concepts of mathematical chemistryCovers applications in diverse areas of physics, chemistry, drug discovery, predictive toxicology, systems biology, chemoinformatics, and bioinformaticsAbout half of the book focuses primarily on current work, new applications, and emerging approaches for the mathematical characterization of essential aspects of molecular structure, while the other half describes applications of structural approach to new drug discovery, virtual screening, protein folding, predictive toxicology, DNA structure, and systems biology
999 _c63682
_d63682