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portada Computer Simulation of Biomolecular Systems: Theoretical and Experimental Applications
Computer Simulation of Biomolecular Systems: Theoretical and Experimental ApplicationsComputer Simulation of Biomolecular Systems: Theoretical and Experimental ApplicationsComputer Simulation of Biomolecular Systems: Theoretical and Experimental Applications
Type
Physical Book
Publisher
Author
Language
English
Pages
618
Format
Hardcover
Dimensions
23.4 x 15.6 x 3.5 cm
Weight
1.08 kg.
ISBN
9072199251
ISBN13
9789072199256
Categories

Computer Simulation of Biomolecular Systems: Theoretical and Experimental Applications

Van Gunsteren, W. F. ; Weiner, P. K. ; Wilkinson, A. J. (Author) · Springer · Hardcover

Computer Simulation of Biomolecular Systems: Theoretical and Experimental Applications - Van Gunsteren, W. F. ; Weiner, P. K. ; Wilkinson, A. J.

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Synopsis "Computer Simulation of Biomolecular Systems: Theoretical and Experimental Applications"

The third volume in the series on Computer Simulation of Biomolecular Systems continues with the format introduced in the first volume [1] and elaborated in the second volume [2]. The primary emphasis is on the methodological aspects of simulations, although there are some chapters that present the results obtained for specific systems of biological interest. The focus of this volume has changed somewhat since there are several chapters devoted to structure-based ligand design, which had only a single chapter in the second volume. It seems useful to set the stage for this volume by quoting from my preface to Volume 2 [2]. "The long-range 'goal of molecular approaches to biology is to describe living systems in terms of chemistry and physics. Over the last fifty years great progress has been made in applying the equations representing the underlying physical laws to chemical problems involv- ing the structures and reactions of small molecules. Corresponding studies of mesoscopic systems have been undertaken much more recently. Molecular dynamics simulations, which are the primary focus of this volume, represent the most important theoretical approach to macromolecules of biological interest." ...

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