A Hybrid Data Base : Quantum Chemistry Literature Data Base II : New Concept and New Methodology

スポンサーリンク

概要

論文の詳細を見る
2010-06-15

著者

関連論文

A Hybrid Data Base : Quantum Chemistry Literature Data Base II : New Concept and New Methodology
A hybrid data base: quantum chemistry literature data base (2) New concept and new methodology
Isotope Effect in Hydrogen/Deuterium-absorbing Pd Nanoparticles Revealed by X-ray Powder Diffraction and by a Multi-component MO Method(Condensed Matter : Structure, Mechanical and Thermal Properties)
Spherical Charge Analysis with Ab Initio Wave Functions : Modefied Oxidation Number of Open Shell Molecule, Ch_2
Isotope Effect on Hydrogen (Deuterium)-Absorbing Pt Clusters Calculated by the Multi-Component Molecular Orbital Method(Cross-disciplinary Physics and Related Areas of Science and Technology)
Computational Study of Excited-State Intramolecular-Proton-Transfer of o-Hydroxybenzaldehyde and Its Derivatives
Dependence of Chemical Shift Difference on Core-Level
Solvent-Polarity Dependence of Antioxidant Kinetics of Vitamin E
Pell Equation. IV. Fastest algorithm for solving the Pell equation
Continuant, caterpillar, and topological index Z. Fastest algorithm for degrading a continued fraction
Continuant, caterpillar, and topological index Z. II. Novel identities involving Fibonacci, Lucas, and generalized Fibonacci numbers
Extraction of a Parameter as an Index to Assess Water Quality of the Tamagawa, Tokyo, Japan, by Using Neural Networks and Multivariate Analysis
A Concealed Property of the Topological Index Z
The Relation between the Eigenvalue Sum and the Topological Index Z Revisited
Molecular Structure Optimization and Molecular Dynamics Using Hamiltonian Algorithm : Structure of Benzodiazepine Minor Tranquilizers : Towards Non-Empirical Drug Design
Calculations and Electronic Analyses of ^Mn and ^C Nuclear Magnetic Shielding Constants for Mn(CO)_5X (X = H, F, Cl, Br, I, and CH_3) and M(CO)(NH_3)_3 (M = Cr^, Fe^, Cu^+, and Zn^)
Gangliosides' Inhibitory Effects on NAD Glycohydrolase : Estimating the Solvation Effect in the Physiological Environment
Pell Equation. I. Systematic classification of the solutions of the Pell equation
Similarity of odor qualities and similarity of molecules : Examples of molecules that contain a cis-type carbon-carbon double bond or a thioether moiety
Theoretical Study of Geometries and Electronic Transition of Color-Switching Molecules : Tetra-Aza Macrocycle and Its Zinc Complexes
Theoretical Study of a Conformational Change Occurring with Lithium Complexation to a Tetra-aza Macrocycle Containing 2,2'-Bipyridines
Classification and Prediction of Reagents' Roles by FRAU system with Self-Organizing Neural Network Model
Theoretical Study on the Transformation of Bis(acetylene)cobalt to Cobaltacyclopentadiene and the Regioselectivity in this Transformation
Theoretical Study on the Disproportionation Reaction of Nickel(II) Mixed-Ligand Complexes Containing N,N,N',N'-Tetramethylethylenediamine, Benzoylacetonate, and a Halide Anion
Solvent-Polarity Dependence of Antioxidant Kinetics of Vitamin E
Some Graph-Theoretical Aspects of the Golden Ratio : Topological Index, Isomatching Graphs, and Golden Family Graphs
Nuclear Magnetic Shielding and Aromaticity of [18]Annulene and Its Quasi-Mobius-Type Analogues
From How to Why. Graph-Theoretical Verification of Quantum-Mechanical Aspects of π-Electron Behaviors in Conjugated Systems
Pell Equation. V. Systematic relation between the Pythagorean triples and Pell equations
3PT225 大規模量子化学計算(FMO法)によるHIV-1糖鎖認識抗体2G12と糖鎖間の相互作用解析(日本生物物理学会第50回年会(2012年度))
Sequences of Polyomino and Polyhex Graphs whose Perfect Matching Numbers are Fibonacci or Lucas Numbers : The Golden Family Graphs of a New Category

もっと見る

スポンサーリンク