Donald G. Truhlar – författare
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15 produkter
Chemical Applications of Atomic and Molecular Electrostatic Potentials
Reactivity, Structure, Scattering, and Energetics of Organic, Inorganic, and Biological Systems
Av Peter Politzer, Donald G. Truhlar
Inbunden, 1981
1638 kr
Lägg i varukorg
On March 26-27, 1980, a symposium organized by one of us (P. P. ) was held at the l79th American Chemical Society National ~1eeting in Houston, Texas, under the sponsorship of the Theoretical Chemistry Subdivision of the Division of Physical Chemistry. The symposium was entitled "The Role of the …
Multiparticle Quantum Scattering with Applications to Nuclear, Atomic and Molecular Physics
Av Donald G. Truhlar, Donald G. Truhlar m. fl.
Inbunden, 1997
876 kr
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The topics in this volume include the ideas of mathematicians, physicists and chemists in the area of multiparticle scattering theory. Scattering theory (or collision theory as it is often called) is a fundamental area of theory and computation in both physics and chemistry. The correct formulation …
Rational Drug Design
Av Anthony J. Hopfinger, Donald G. Truhlar m. fl.
Inbunden, 1999
1094 kr
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Drug research and discovery are of critical importance in human health care. Computational approaches for drug lead discovery and optimization have proven successful in many recent research programs. These methods have grown in their effectiveness not only because of improved understanding of the …
Monte Carlo Methods in Chemical Physics, Volume 105
Av Donald G. Truhlar, J. Ilja Siepmann m. fl.
E-bok, 2009
7267 kr
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In Monte Carlo Methods in Chemical Physics: An Introduction to the Monte Carlo Method for Particle Simulations J. Ilja Siepmann Random Number Generators for Parallel Applications Ashok Srinivasan, David M. Ceperley and Michael Mascagni Between Classical and Quantum Monte Carlo Methods: …
Monte Carlo Methods in Chemical Physics, Volume 105
Inbunden, 1998
6250 kr
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In Monte Carlo Methods in Chemical Physics: An Introduction to the Monte Carlo Method for Particle Simulations J. Ilja Siepmann Random Number Generators for Parallel Applications Ashok Srinivasan, David M. Ceperley and Michael Mascagni Between Classical and Quantum Monte Carlo Methods: …
Domain-Based Parallelism and Problem Decomposition Methods in Computational Science and Engineering
Av David E. Keyes, Youcef Saad m. fl.
Häftad, 1995
1141 kr
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This refereed volume arose from the editors' recognition that physical scientists, engineers, and applied mathematicians are developing, in parallel, solutions to problems of parallelization. The cross-disciplinary field of scientific computation is bringing about better communication between …
Rational Drug Design
Av Richard E. Dammkoehler, Jeff Blaney m. fl.
E-bok, 2012
1459 kr
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Drug research and discovery are of critical importance in human health care. Computational approaches for drug lead discovery and optimization have proven successful in many recent research programs. These methods have grown in their effectiveness not only because of improved understanding of the …
Multiparticle Quantum Scattering with Applications to Nuclear, Atomic and Molecular Physics
Av Barry Simon, Donald G. Truhlar
E-bok, 2012
734 kr
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This IMA Volume in Mathematics and its Applications MULTIPARTICLE QUANTUM SCATTERING WITH APPLICATIONS TO NUCLEAR, ATOMIC AND MOLECULAR PHYSICS is based on the proceedings of a workshop with the same title, which was an integral part of the 1994-1995 IMA program on "Waves and Scattering." We would …
Rational Drug Design
Av Donald G. Truhlar, W. Jeffrey Howe m. fl.
Häftad, 2012
1094 kr
Lägg i varukorg
Drug research and discovery are of critical importance in human health care. Computational approaches for drug lead discovery and optimization have proven successful in many recent research programs. These methods have grown in their effectiveness not only because of improved understanding of the …
Multiparticle Quantum Scattering with Applications to Nuclear, Atomic and Molecular Physics
Av Donald G. Truhlar, Barry Simon
Häftad, 2012
551 kr
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This IMA Volume in Mathematics and its Applications MULTIPARTICLE QUANTUM SCATTERING WITH APPLICATIONS TO NUCLEAR, ATOMIC AND MOLECULAR PHYSICS is based on the proceedings of a workshop with the same title, which was an integral part of the 1994-1995 IMA program on "Waves and Scattering." We would …
Mathematical Frontiers in Computational Chemical Physics
Häftad, 2012
1095 kr
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This IMA Volume in Mathematics and its Applications MATHEMATICAL FRONTIERS IN COMPUTATIONAL CHEMICAL PHYSICS is in part the proceedings of a workshop which was an integral part of the 1986-87 IMA program on SCIENTIFIC COMPUTATION. We are grateful to the Scientific Committee: Bjorn Engquist …
Chemical Applications of Atomic and Molecular Electrostatic Potentials
Reactivity, Structure, Scattering, and Energetics of Organic, Inorganic, and Biological Systems
Av Donald G. Truhlar, Peter Politzer
E-bok, 2013
2065 kr
Lägg i varukorg
On March 26-27, 1980, a symposium organized by one of us (P. P. ) was held at the l79th American Chemical Society National ~1eeting in Houston, Texas, under the sponsorship of the Theoretical Chemistry Subdivision of the Division of Physical Chemistry. The symposium was entitled "The Role of the …
Chemical Applications of Atomic and Molecular Electrostatic Potentials
Reactivity, Structure, Scattering, and Energetics of Organic, Inorganic, and Biological Systems
Av Peter Politzer, Donald G. Truhlar
Häftad, 2013
1638 kr
Lägg i varukorg
On March 26-27, 1980, a symposium organized by one of us (P. P. ) was held at the l79th American Chemical Society National ~1eeting in Houston, Texas, under the sponsorship of the Theoretical Chemistry Subdivision of the Division of Physical Chemistry. The symposium was entitled "The Role of the …
Perspectives on Theoretical Chemistry
Five Decades of Theoretical Chemistry Accounts and Theoretica Chimica Acta
Av Christopher J. Cramer, Donald G. Truhlar
Inbunden, 2012
1098 kr
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On the occasion of the 50th anniversary of the journal Theoretical Chemistry Accounts, leading researchers in theoretical chemistry present current and forward-looking perspectives on major developments in the field. Originally published in the journal, these outstanding contributions are now …
Perspectives on Theoretical Chemistry
Five Decades of Theoretical Chemistry Accounts and Theoretica Chimica Acta
Av Christopher J. Cramer, Donald G. Truhlar
Häftad, 2014
1098 kr
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On the occasion of the 50th anniversary of the journal Theoretical Chemistry Accounts, leading researchers in theoretical chemistry present current and forward-looking perspectives on major developments in the field. Originally published in the journal, these outstanding contributions are now …
