Computational organic chemistry

Computational organic chemistry

by Bachrach, Steven M.

Type Book
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Building upon and updating the successful first edition, the second edition of Computational Organic Chemistry introduces computational modeling methods used as standard tools by organic chemists for searching, rationalizing, and predicting structure and reactivity of organic molecules. New coverage includes: significant problems with standard DFT (density functional theory) methods; ways to address these problems; computational organic spectroscopy; computational tools for understanding enzyme…

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Title Statements

  • Full title :Computational organic chemistry / Steven M. Bachrach.

Summary

Building upon and updating the successful first edition, the second edition of Computational Organic Chemistry introduces computational modeling methods used as standard tools by organic chemists for searching, rationalizing, and predicting structure and reactivity of organic molecules. New coverage includes: significant problems with standard DFT (density functional theory) methods; ways to address these problems; computational organic spectroscopy; computational tools for understanding enzyme mechanisms; and new interviews. The text is particularly valuable to organic, physical organic, synt.

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Edition Statements

  • Publication Date:2014.
  • Edition:Second edition

Publication Statements

  • Publisher(s):Wiley
  • Place of Publication:Hoboken, New Jersey
  • Language:eng
  • Publication Date:2014.

Notes

Titre de l'écran-titre (visionné le 6 mai 2015).

TRAITEMENT SOMMAIRE.

The Physical Object

  • Description:1 ressource en ligne (640 p.)

Edition Identifiers

  • ISBN:9781118671139, 1118671139
  • oclc:ocn908743941
  • LC Classification:QD255.5.M35
  • Dewey Decimal:547.001/51

Subjects

Chemistry, Organic -- Mathematical mode… Chemistry, Organic -- Mathematics Chimie organique -- Mathématiques Chimie organique -- Modèles mathématiqu… e-books Livres électroniques Livres numériques

Writers

Bachrach, Steven M.

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