Practical Aspects of Computational Chemistry
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Published By Springer Netherlands

9789048126866, 9789048126873

Latest Documents Most Cited Documents Contributed Authors Related Sources Related Keywords

Challenging the Multiple Minima Problem: Example of Protein Folding

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_5 ◽

2009 ◽

pp. 137-148

Author(s):

Lucjan Piela

Keyword(s):

Protein Folding ◽

Multiple Minima

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Quantitative Structure–Activity Relationships (QSARs) in the European REACH System: Could These Approaches be Applied to Nanomaterials?

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_9 ◽

2009 ◽

pp. 201-216 ◽

Cited By ~ 3

Author(s):

Tomasz Puzyn ◽

Danuta Leszczynska ◽

Jerzy Leszczynski

Keyword(s):

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Multiscale Modeling: A Review

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_4 ◽

2009 ◽

pp. 87-135 ◽

Cited By ~ 46

Author(s):

M. F. Horstemeyer

Keyword(s):

Multiscale Modeling

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Efficient and Accurate Electron Propagator Methods and Algorithms

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_1 ◽

2009 ◽

pp. 1-17 ◽

Cited By ~ 5

Author(s):

Roberto Flores-Moreno ◽

J. V. Ortiz

Keyword(s):

Electron Propagator

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Toward Understanding of Hydrogen Storage in Single-Walled Carbon Nanotubes by Investigations of Chemisorption Mechanism

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_14 ◽

2009 ◽

pp. 297-313 ◽

Cited By ~ 7

Author(s):

T. C. Dinadayalane ◽

Jerzy Leszczynski

Keyword(s):

Carbon Nanotubes ◽

Hydrogen Storage ◽

Single Walled Carbon Nanotubes ◽

Single Walled Carbon ◽

Walled Carbon Nanotubes

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An Overview of σ-Hole Bonding, an Important and Widely-Occurring Noncovalent Interaction

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_6 ◽

2009 ◽

pp. 149-163 ◽

Cited By ~ 11

Author(s):

Peter Politzer ◽

Jane S. Murray

Keyword(s):

Noncovalent Interaction

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Conformational Flexibility of Pyrimidine Ring in Nucleic Acid Bases

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_21 ◽

2009 ◽

pp. 399-413 ◽

Cited By ~ 2

Author(s):

Oleg V. Shishkin ◽

Leonid Gorb ◽

Jerzy Leszczynski

Keyword(s):

Nucleic Acid ◽

Pyrimidine Ring ◽

Conformational Flexibility ◽

Nucleic Acid Bases

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Structure–Activity Relationships in Nitro-Aromatic Compounds

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_10 ◽

2009 ◽

pp. 217-240 ◽

Cited By ~ 1

Author(s):

R. A. Vogt ◽

S. Rahman ◽

C. E. Crespo-Hernández

Keyword(s):

Aromatic Compounds ◽

Structure Activity Relationships ◽

Structure Activity ◽

Nitro Aromatic

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Nucleic Acid Base Complexes: Elucidation of the Physical Origins of Their Stability

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_20 ◽

2009 ◽

pp. 387-397

Author(s):

Żaneta Czyżnikowska ◽

Robert Zaleśny ◽

Manthos G. Papadopoulos

Keyword(s):

Nucleic Acid ◽

Acid Base ◽

Nucleic Acid Base

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Stability and Structures of the DNA Base Tetrads: A Role of Metal Ions

Practical Aspects of Computational Chemistry ◽

10.1007/978-90-481-2687-3_23 ◽

2009 ◽

pp. 445-453

Author(s):

Jiande Gu ◽

Jing Wang ◽

Jerzy Leszczynski

Keyword(s):

Metal Ions ◽

Dna Base

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Practical Aspects of Computational ChemistryLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By Springer Netherlands

Challenging the Multiple Minima Problem: Example of Protein Folding

Quantitative Structure–Activity Relationships (QSARs) in the European REACH System: Could These Approaches be Applied to Nanomaterials?

Multiscale Modeling: A Review

Efficient and Accurate Electron Propagator Methods and Algorithms

Toward Understanding of Hydrogen Storage in Single-Walled Carbon Nanotubes by Investigations of Chemisorption Mechanism

An Overview of σ-Hole Bonding, an Important and Widely-Occurring Noncovalent Interaction

Conformational Flexibility of Pyrimidine Ring in Nucleic Acid Bases

Structure–Activity Relationships in Nitro-Aromatic Compounds

Nucleic Acid Base Complexes: Elucidation of the Physical Origins of Their Stability

Stability and Structures of the DNA Base Tetrads: A Role of Metal Ions

Practical Aspects of Computational Chemistry
Latest Publications