WorldCat Identities

Karplus, Martin 1930-

Overview
Works: 50 works in 123 publications in 2 languages and 1,905 library holdings
Genres: Exhibition catalogs  Examinations  Academic theses 
Roles: Author, Other, Honoree, Editor, Opponent, Photographer
Publication Timeline
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Most widely held works about Martin Karplus
 
Most widely held works by Martin Karplus
Atoms and molecules; an introduction for students of physical chemistry by Martin Karplus( Book )

25 editions published between 1970 and 1992 in English and held by 731 WorldCat member libraries worldwide

A guide to biomolecular simulations by Oren M Becker( )

16 editions published in 2006 in English and held by 572 WorldCat member libraries worldwide

Molecular dynamics simulations have become instrumental in replacing our view of proteins as relatively rigid structures with the realization that they were dynamic systems, whose internal motions play a functional role. Over the years, such simulations have become a central part of biophysics. Applications of molecular dynamics in biophysics range over many areas. They are used in the structure determination of macromolecules with x-ray and NMR data, the modelling of unknown structures from their sequence, the study of enzyme mechanisms, the estimation of ligand-binding free energies, the evaluation of the role of conformational change in protein function, and drug design for targets of known structures. The widespread application of molecular dynamics and related methodologies suggests that it would be useful to have available an introductory self-contained course by which students with a relatively limited background in chemistry, biology and computer literacy, can learn the fundamentals of the field. This Guide to Biomolecular Simulations tries to fill this need. The Guide consists of six chapters which provide the fundamentals of the field and six chapters which introduce the reader to more specialized but important applications of the methodology
Proteins : a theoretical perspective of dynamics, structure, and thermodynamics by Charles L Brooks( Book )

20 editions published between 1987 and 2009 in English and held by 501 WorldCat member libraries worldwide

Presenting a wide-ranging view of current developments in protein research, the papers in this collection, each written by highly regarded experts in the field, examine various aspects of protein structure, functions, dynamics, and experimentation. Topics include dynamical simulation methods, the biological role of atom fluctuations, protein folding, influences on protein dynamics, and a variety of analytical techniques, such as X-ray diffraction, vibrational spectroscopy, photodissociation and rebinding kinetics. This is part of a series devoted to providing general information on a wide vari
Solutions manual for atoms and molecules; an introduction for students of physical chemistry by Martin Karplus( Book )

6 editions published between 1971 and 1981 in English and held by 13 WorldCat member libraries worldwide

Proteins by Charles L Brooks( Book )

2 editions published between 1988 and 2009 in English and held by 10 WorldCat member libraries worldwide

Presenting a wide-ranging view of current developments in protein research, the papers in this collection, each written by highly regarded experts in the field, examine various aspects of protein structure, functions, dynamics, and experimentation. Topics include dynamical simulation methods, the biological role of atom fluctuations, protein folding, influences on protein dynamics, and a variety of analytical techniques, such as X-ray diffraction, vibrational spectroscopy, photodissociation and rebinding kinetics. This is part of a series devoted to providing general information on a wide vari
Chemical thermodynamics by John G Kirkwood( Book )

4 editions published in 1951 in English and held by 7 WorldCat member libraries worldwide

Reproduction of typescript; contains fifteen chapters with notes by Irwin Oppenheim, Martin Karplus, Alexander Rich
Advances in chemical physics, Volume 71, Proteins a theoretical perspective of dynamics, structure, and thermodynamics by Charles L Brooks( )

1 edition published in 1988 in English and held by 6 WorldCat member libraries worldwide

Martin Karplus festschrift( Book )

1 edition published in 1996 in English and held by 4 WorldCat member libraries worldwide

Special issue on molecular simulations of biomolecules( Book )

4 editions published in 2002 in English and held by 4 WorldCat member libraries worldwide

1980 Association of Harvard Chemists alumni symposium( Visual )

2 editions published in 1980 in English and held by 3 WorldCat member libraries worldwide

Proteins : a theoretical perspective of dynamics, structure, and thermodynamics by Charles L Brooks( )

1 edition published in 1988 in English and held by 3 WorldCat member libraries worldwide

Frontiers in computational biophysics : a symposium in honor of Martin Karplus( )

1 edition published in 2005 in English and held by 2 WorldCat member libraries worldwide

Collision dynamics of chemical reactions( Visual )

1 edition published in 1972 in English and held by 2 WorldCat member libraries worldwide

A hybrid QM-MM potential employing Hartree-Fock or density functional methods in the quantum region by Paul D Lyne( )

1 edition published in 1999 in English and held by 2 WorldCat member libraries worldwide

Martin Karplus : la couleur des années 1950 by Martin Karplus( Book )

1 edition published in 2013 in French and held by 1 WorldCat member library worldwide

Martin Karplus (né à Vienne en 1930, vivant aux Etats-Unis depuis 1938), scientifique mondialement reconnu pour ses travaux (entre autres, il est un pionnier de la théorie chimique de résonance magnétique nucléaire) a aussi pratiqué la photographie en couleurs entre 1954 et 1965 : une bourse de la National Science Foundation lui a permis de visiter toute let#x92;Europe, muni det#x92;un Leica IIIC. Pendant cette pause dans une vie consacrée à la science, il net#x92;a cessé de produire des photographies avec les premières diapositives Kodachrome. 0Il a poursuivi ce travail durant quelques années aux Etats-Unis, en Amérique du Sud et en Asie. La centaine det#x92;images sélectionnées parmi les milliers réalisées en quelques années, témoignent du regard curieux et profondément humaniste det#x92;un très grand chercheur
A quantum-mechanical discussion of the bifluoride ion by Martin Karplus( )

1 edition published in 1954 in Undetermined and held by 1 WorldCat member library worldwide

NOTE: Text or symbols not renderable in plain ASCII are indicated by [...]. Abstract is included in .pdf document. The variation method for obtaining approximate solutions to the Schrodinger equation is examined. It is demonstrated that one-electron orbitals can to employed in the construction of a convergent variation function. As special cases of the one-electron approach, the valence bond and molecular orbital methods are discused and compared. Variation functions containing only a few terms are known to lead to incorrect results. The reasons for this failure are discussed. A semi-theoretical apnroach, which corrects some of the failings, is developed and tested on HF. Results in good agreement with experimental determinations of the energy and dipole moment are obtained. Application of the method to [...] leads to a value of 36.5 kcal for the energy of the reaction [...]. Calculation of the [...] wave funtion shows that the completely ionic structure ([...]) makes the largest contribution
A quantum-mechanical discussion of the bifluoride ion by Martin Karplus( Book )

1 edition published in 1954 in English and held by 1 WorldCat member library worldwide

Au temps jadis : Martin Karplus : [exposition, Strasbourg, Stimultania, 16 mai-20 juillet 2008]( Book )

1 edition published in 2008 in English and held by 1 WorldCat member library worldwide

Properties of mass and uses of natural orbitals by Ernest R Davidson( Book )

1 edition published in 1972 in English and held by 1 WorldCat member library worldwide

Theoretical interpretation of carbon-13 hyperfine interactions in electron spin resonance spectra( Book )

1 edition published in 1961 in English and held by 1 WorldCat member library worldwide

A quantitative theory of the isotropic electronnuclear spin interactions of C-13 in pi-electron radicals is presented and applied to the hyperfine splittings observed in the electron spin resonance spectra of these substances. The theory predicts both the magnitude and sign of the hyperfine splittings and is readily applied to a variety of compounds. For the methyl radical, the measured C-13 splitting is shown to be consistent with a planar model and limits the deviation from planarity to less than or approximately equal to 5 degrees. The theory provides a useful criterion for the validity of approximate wave functions. The sigma-pi interaction parameters are shown to depend on the bond length, the type of hybridization, and on the nature of the bonding atoms. For pi-electron systems, the results demonstrate that the magnitude of the sigma-pi exchange energy is a small fraction of the total energy. (Author)
 
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A guide to biomolecular simulations
Covers
Proteins : a theoretical perspective of dynamics, structure, and thermodynamicsProteinsProteins : a theoretical perspective of dynamics, structure, and thermodynamics
Alternative Names
Karplus, M. 1930-

Martin Karplus americký chemik

Martin Karplus amerikanischer theoretischer Chemiker

Martin Karplus amerikansk kemiker

Martin Karplus amerikansk kemist

Martin Karplus amerikansk kjemikar

Martin Karplus amerikansk kjemiker

Martin Karplus chimico austriaco naturalizzato statunitense

Martin Karplus chimiste américain

Martin Karplus scheikundige uit Oostenrijk

Martinus Karplus

Мартин Карплус

Мартін Карплус

Марцін Карплюс

מרטין קרפלוס

مارتين كاربلوس

مارتین کارپلاس شیمی‌دان آمریکایی

مارتین کارپلوس

مارٹن کارپلس

मार्टिन कारप्लस

মার্টিন কারপ্লাস

மார்ட்டின் கார்ப்பிளசு

마틴 카플러스

マーティン・カープラス

马丁·卡普拉斯

Languages
English (94)

French (2)