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Search results for “[subject: chemistry-computational-molecular-modeling]”

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Computational Chemistry with Python: A Practical Introduction to Molecular Orbitals, Quantum Methods, Geometry Optimization, and Energy Calculations

Danny Munrow, Livia Arden

Paperback

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₹3,187
Current price ₹3,187

• Author(s): Danny Munrow | Livia Arden • Publisher: Independently Published • Publisher Imprint: Independently Published • BISAC: Languages - PythonReactive PublishingComputational chemistry allows researchers, students, and technical profession...

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Reviews in Computational Chemistry

Kenny B. Lipkowitz

Hardcover

Current price ₹31,127
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₹31,127
Current price ₹31,127

• Author(s): Kenny B. Lipkowitz • Publisher: Wiley-Vch • Publisher Imprint: Wiley-Vch • BISAC: Chemistry - Physical & TheoreticalNot only a major reference work for sale to the library market, Reviews in Computational Chemistry is now a purch...

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Reviews in Computational Chemistry

Kenny B. Lipkowitz

Hardcover

Current price ₹31,167
Original price ₹35,541
Original price ₹35,541
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₹31,167
Current price ₹31,167

• Author(s): Kenny B. Lipkowitz • Publisher: Wiley-Vch • Publisher Imprint: Wiley-Vch • BISAC: Chemistry - Physical & TheoreticalThis second volume of the series 'Reviews in Computational Chemistry' explores new applications, new methodologie...

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Hybrid Methods of Molecular Modeling

Andrei L. Tchougréeff

Paperback

Current price ₹36,335
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• Author(s): Andrei L. Tchougréeff • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalFrom the Back CoverHybrid Methods of Molecular Modeling is a self-contained advanced review volume. It provides ...

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Foundations of Molecular Modeling and Simulation: Select Papers from Fomms 2015

Randall Q. Snurr

Hardcover

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• Author(s): Randall Q. Snurr • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemical & BiochemicalFrom the Back CoverThis book is a collection of select proceedings of the FOMMS 2015 conference. FOMMS 2015 is the sixth triennia...

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Reviews in Computational Chemistry

Abby L. Parrill

Hardcover

Current price ₹14,423
Original price ₹22,189
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₹14,423
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• Author(s): Abby L. Parrill • Publisher: Wiley • Publisher Imprint: Wiley • BISAC: Chemistry - Physical & TheoreticalThe Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and upd...

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Computational Studies of RNA and DNA

Jirí Sponer, Filip Lankas

Hardcover

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• Author(s): Jirí Sponer | Filip Lankas • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalComputational Studies of RNA and DNA includes, in an integrated way, modern computational studies of nuclei...

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Quantum Modeling of Complex Molecular Systems

Jean-Louis Rivail

Hardcover

Current price ₹10,900
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• Author(s): Jean-Louis Rivail • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Computational & Molecular ModelingFrom the Back CoverThis multi-author contributed volume includes methodological advances and original ap...

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Reviews in Computational Chemistry, Volume 21

Editor: Kenny B. Lipkowitz, Editor: Raima Larter, Editor: Thomas R. Cundari

Hardcover

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Original price ₹36,004
Original price ₹36,004
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• Author(s): Editor: Kenny B. Lipkowitz | Editor: Raima Larter | Editor: Thomas R. Cundari • Publisher: Wiley • Publisher Imprint: Wiley-VCH • BISAC: Computer SimulationREVIEWS IN COMPUTATIONAL CHEMISTRY Kenny B. Lipkowitz, Raima Larter, and Thom...

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Reviews in Computational Chemistry

Kenny B. Lipkowitz

Hardcover

Current price ₹31,111
Original price ₹35,541
Original price ₹35,541
Original price ₹35,541
(-12%)
₹31,111
Current price ₹31,111

• Author(s): Kenny B. Lipkowitz • Publisher: Wiley-Vch • Publisher Imprint: Wiley-Vch • BISAC: Chemistry - Physical & TheoreticalFrom reviews of the series: 'Many of the articles are indeed accessible to any interested nonspecialist, even wi...

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Molecular Materials with Specific Interactions - Modeling and Design

W. Andrzej Sokalski

Paperback

Current price ₹10,900
Original price ₹16,769
Original price ₹16,769
Original price ₹16,769
(-35%)
₹10,900
Current price ₹10,900

• Author(s): W. Andrzej Sokalski • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalFrom the Back Cover"Molecular Materials with Specific Interactions: Modeling and Design" has a very interdisciplin...

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Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics

Errol G. Lewars

Hardcover

Current price ₹9,447
Original price ₹14,533
Original price ₹14,533
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(-35%)
₹9,447
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• Author(s): Errol G. Lewars • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalFrom the Back CoverThis is the fourth edition of the successful textbook on computational chemistry which continues to...

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Reviews in Computational Chemistry

Abby L. Parrill

Hardcover

Current price ₹13,990
Original price ₹21,522
Original price ₹21,522
Original price ₹21,522
(-35%)
₹13,990
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• Author(s): Abby L. Parrill • Publisher: Wiley • Publisher Imprint: Wiley • BISAC: Chemistry - Physical & TheoreticalThe Reviews in Computational Chemistry series brings together leading authorities in the field to teach the newcomer and upd...

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Methods in Computational Chemistry: Volume 2 Relativistic Effects in Atoms and Molecules

Stephen Wilson

Paperback

Current price ₹3,633
Original price ₹5,589
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₹3,633
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• Author(s): Stephen Wilson • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Computational & Molecular ModelingThisvolume isdevotedtomethodsfor thestudyoftheeffectsofrelativity on theelectronicstructure ofatomsand mole...

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Fundamental Principles of Molecular Modeling

Anton Amann

Hardcover

Current price ₹7,267
Original price ₹11,179
Original price ₹11,179
Original price ₹11,179
(-35%)
₹7,267
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• Author(s): Anton Amann • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalMolecular similarity has always been an important conceptual tool of chemists, yet systematic approaches to molecular simi...

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Molecular Materials with Specific Interactions - Modeling and Design

W. Andrzej Sokalski

Hardcover

Current price ₹10,900
Original price ₹16,769
Original price ₹16,769
Original price ₹16,769
(-35%)
₹10,900
Current price ₹10,900

• Author(s): W. Andrzej Sokalski • Publisher: Springer • Publisher Imprint: Springer • BISAC: Materials Science - GeneralFrom the Back Cover"Molecular Materials with Specific Interactions: Modeling and Design" has a very interdisciplinary charact...

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Molecular Electromagnetism: A Computational Chemistry Approach

Stephan P. a. Sauer

Hardcover

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Original price ₹16,148
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₹13,456
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• Author(s): Stephan P. a. Sauer • Publisher: Oxford University Press, USA • Publisher Imprint: Oxford University Press, USA • BISAC: Physics - ElectricityThis is a textbook on the theory and calculation of molecular electromagnetic and spectrosc...

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Advances in Computational and Theoretical Chemistry: From Molecules to Materials

Nadia Faska

Paperback

Current price ₹23,692
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(-2%)
₹23,692
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• Author(s): Nadia Faska • Publisher: Igi Global Scientific Publishing • Publisher Imprint: Igi Global Scientific Publishing • BISAC: Chemistry - Computational & Molecular Modeling

Computational Quantum Chemistry: Molecular Structure and Properties in Silico

Joseph J. W. McDouall

Hardcover

Current price ₹16,423
Original price ₹19,708
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(-17%)
₹16,423
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• Author(s): Joseph J. W. McDouall • Publisher: Royal Society of Chemistry • Publisher Imprint: Royal Society of Chemistry • BISAC: Chemistry - Physical & TheoreticalComputational Quantum Chemistry presents computational electronic structure ...

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Intermolecular Interactions: Physical Picture, Computational Methods and Model Potentials

Ilya G. Kaplan

Hardcover

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Original price ₹21,752
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(-12%)
₹19,092
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• Author(s): Ilya G. Kaplan • Publisher: Wiley • Publisher Imprint: Wiley • BISAC: Chemistry - Physical & TheoreticalThe subject of this book — intermolecular interactions — is as important in physics as in chemistry and molecular biology. In...

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Computational Methods for the Multiscale Modeling of Soft Matter

Paola Carbone, Nigel Clarke

Paperback

Current price ₹11,430
Original price ₹19,050
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₹11,430
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• Author(s): Paola Carbone | Nigel Clarke • Publisher: Elsevier Science • Publisher Imprint: Elsevier Science • BISAC: Chemistry - Physical & TheoreticalThis book provides a concise description of a variety of simulation methods to model soft...

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Advanced Computational Techniques in Chemistry: Insights from Multiwfn, ONIOM, and Molecular Docking

Benzir Ahmed

Paperback

Current price ₹4,378
Original price ₹6,321
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(-31%)
₹4,378
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• Author(s): Benzir Ahmed • Publisher: Eliva Press • Publisher Imprint: Eliva Press • BISAC: Chemistry - GeneralThis book offers a comprehensive analysis of advanced computational methodologies viz. Multiwfn, ONIOM and Molecular Docking, which ha...

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Advances in Computational and Theoretical Chemistry: From Molecules to Materials

Nadia Faska

Hardcover

Current price ₹27,573
Original price ₹28,158
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(-2%)
₹27,573
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• Author(s): Nadia Faska • Publisher: Igi Global Scientific Publishing • Publisher Imprint: Igi Global Scientific Publishing • BISAC: Chemistry - Computational & Molecular Modeling

Computational Chemistry

Le Bris, Claude

Hardcover

Current price ₹12,288
Original price ₹20,479
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(-40%)
₹12,288
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• Author(s): Le Bris, Claude • Publisher: Elsevier Science • Publisher Imprint: Elsevier ScienceAiming to provide the reader with a general overview of the mathematical and numerical techniques used for the simulation of matter at the microscopic...

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Frontiers in Computational Chemistry Volume 4

Angela K. Wilson

Paperback

Current price ₹13,021
Original price ₹15,092
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(-14%)
₹13,021
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• Author(s): Angela K. Wilson • Publisher: Bentham Science Publishers • Publisher Imprint: Bentham Science Publishers • BISAC: Chemistry - Computational & Molecular ModelingFrontiers in Computational Chemistry presents contemporary research o...

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Molecular Modeling of the Sensitivities of Energetic Materials

Didier Mathieu

Paperback

Current price ₹12,573
Original price ₹20,955
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(-40%)
₹12,573
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• Author(s): Didier Mathieu • Publisher: Elsevier • Publisher Imprint: Elsevier • BISAC: Chemistry - Physical & TheoreticalMolecular Modeling of the Sensitivities of Energetic Materials, Volume 22 introduces experimental aspects, explores the...

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Computational Chemistry

Jeremy Harvey

Paperback

Current price ₹4,306
Original price ₹4,553
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(-5%)
₹4,306
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• Author(s): Jeremy Harvey • Publisher: Oxford University Press, USA • Publisher Imprint: Oxford University Press, USA • BISAC: Chemistry - ClinicalThe renowned Oxford Chemistry Primers series, which provides focused introductions to a range of i...

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Computational Drug Delivery: Molecular Simulation for Pharmaceutical Formulation

Pooja A. Chawla, Dilpreet Singh, Kamal Dua

Hardcover

Current price ₹17,965
Original price ₹21,558
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₹17,965
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• Author(s): Pooja A. Chawla | Dilpreet Singh | Kamal Dua • Publisher: de Gruyter • Publisher Imprint: de Gruyter • BISAC: Chemistry - Industrial & TechnicalThe book bridges the gap between pharmaceutics and molecular modelling at the micro, ...

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Linear-Scaling Techniques in Computational Chemistry and Physics: Methods and Applications

Robert Zaleśny

Hardcover

Current price ₹23,981
Original price ₹36,893
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(-35%)
₹23,981
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• Author(s): Robert Zaleśny • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Computational & Molecular ModelingFrom the Back CoverComputational chemistry methods have become increasingly important in recent years, as m...

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Molecular Physical Chemistry: A Computer-Based Approach Using Mathematica(r) and Gaussian

Jose J. C. Teixeira-Dias

Hardcover

Current price ₹7,994
Original price ₹12,297
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(-35%)
₹7,994
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• Author(s): Jose J. C. Teixeira-Dias • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalThis is the physical chemistry textbook for students with an affinity for computers! It offers basic and adva...

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Reviews In Computational Chemistry

Kenny B. Lipkowitz, Thomas R. Cundari

Hardcover

Current price ₹24,522
Original price ₹27,951
Original price ₹27,951
Original price ₹27,951
(-12%)
₹24,522
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• Author(s): Kenny B. Lipkowitz | Thomas R. Cundari • Publisher: Wiley • Publisher Imprint: Wiley-Blac • Subject: Chemistry • BISAC: Chemistry - Physical & TheoreticalFrom the Back CoverVOLUME 25 Reviews in Computational Chemistry Kenny B. Li...

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Drug Design Strategies: Computational Techniques and Applications

Lee Banting, Tim Clark

Hardcover

Current price ₹18,823
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(-2%)
₹18,823
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• Author(s): Lee Banting | Tim Clark • Publisher: Royal Society of Chemistry • Publisher Imprint: Royal Society of Chemistry • BISAC: Chemistry - Physical & TheoreticalThis book documents the latest research into the theory and application of...

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Molecular Physical Chemistry: A Computer-Based Approach Using Mathematica(r) and Gaussian

José J. C. Teixeira-Dias

Paperback

Current price ₹5,813
Original price ₹8,943
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(-35%)
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• Author(s): José J. C. Teixeira-Dias • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalFrom the Back CoverThis is the physical chemistry textbook for students with an affinity for computers! It of...

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Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics

Errol G. Lewars

Paperback

Current price ₹7,267
Original price ₹11,179
Original price ₹11,179
Original price ₹11,179
(-35%)
₹7,267
Current price ₹7,267

• Author(s): Errol G. Lewars • Publisher: Springer • Publisher Imprint: Springer • BISAC: Chemistry - Physical & TheoreticalThis is the fourth edition of the successful textbook on computational chemistry which continues to provide a comprehe...

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Advances In The Theory Of Atomic And Molecular Systems: Conceptual and Computational Advances in Quantum Chemistry

Piotr Piecuch, Jean Maruani, Gerardo Delgado-Barrio

Hardcover

Current price ₹14,534
Original price ₹22,359
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• Author(s): Piotr Piecuch | Jean Maruani | Gerardo Delgado-Barrio • Publisher: Springer Verlag • Publisher Imprint: Springer V • Subject: Chemistry • BISAC: Chemistry - Physical & TheoreticalFrom the Back CoverQuantum mechanics is the fundam...

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Chemical Theory and Multiscale Simulation in Biomolecules: From Principles to Case Studies

Guohui Li

Paperback

Current price ₹22,772
Original price ₹27,327
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(-17%)
₹22,772
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• Author(s): Guohui Li • Publisher: Elsevier • Publisher Imprint: Elsevier • BISAC: Life Sciences - BiophysicsChemical Theory and Multiscale Simulation in Biomolecules: From Principles to Case Studies helps readers understand what simulation is, ...

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