A-F
-
G
-
-
Gas chromatograph mass-spectrometry
-
Discrimination of Marihuana Using Cluster Analysis
Vol.2, No.4, p.220 (1995)
-
Gas chromatography
-
Discrimination of Marihuana Using Cluster Analysis
Vol.2, No.4, p.220 (1995)
-
Gauss elimination
-
Development of a Program for Analyzing Solvate in Organic Elemental Analysis
Vol.6, No.4, p.137 (2000)
-
GC/MS
-
Elucidation of fragmentation pathway of long chain
base by molecular orbital calculation
Vol.3, No.4, p.139 (1997)
-
Geometry optimization
-
Photochromism and Structural Chemistry of
Benzo[1,2,3-kl : 4,5,6-k'l']dixanthene and its analogues
Vol.2, No.1, p.25 (1994)
-
GetValue
-
GetValue for Windows - Graph Digitizer Equipped with Electrochemical Analyzer
Vol.8, No.1, p.37 (2002)
-
Gibbs free energy
-
A Study on Docking Mode of HIV Protease and Their Inhibitors
Vol.7, No.3, p103 (2001)
-
Graph digitizer
-
GetValue for Windows - Graph Digitizer Equipped with Electrochemical Analyzer
Vol.8, No.1, p.37 (2002)
-
Graphic software
-
Programming of a Graphic Software Composed of
a Set of Mouse-subroutines for Chemical Education
Vol.1, No.3,4 p.177 (1993)
-
Graphic tool
-
Development of a Set of BASIC Subroutines for CAI
Vol.2, No.1, p.17 (1994)
-
GRAPE
-
Molecular Dynamics Simulation of Biological Molecules (1) Methods
Vol.6 No.1, (2000)
-
Graphical Characteristics
-
Development of Graphical Characteristics Data Base : GCDB
-Graphical Characteristics of Multi-Layered Cyclic Fence Graph-
Vol.5, No.4, p.137 (1999)
-
Graphics
-
Development of a Molecular Graphics Program on Sun Workstation.
Vol.2, No.4, p.212 (1995)
-
GRAvity piPE
-
Molecular Dynamics Simulation of Biological Molecules (1) Methods
Vol.6 No.1, (2000)
-
GUI
-
Development of Band-Shape Analysis with GUI
Vol.6, No.2, (2000)
-
H
-
-
1H-NMR
-
1H-NMR Database of Sugars for a Carbohydrate Chemist
Vol.2, No.4, p.196 (1995)
-
1H-NMR spectra
-
Development of a Quality Control System for 1H-NMR Spectral Databases
Vol.7, No.3, p.65 (2001)
-
Hardness
-
Development of a Neural Network Simulator for Structure-Activity Correlation of Molecules: Neco (6)
- Estimation of Mechanical Properties of Cr-Mo Steel, Ni Steel, Ni-Cr Steel and Ni-Cr-Mo Steel -
Vol.7, No.4, p.179 (2001)
-
Hexagonal arrangements
-
Conformational Analysis of Hexagonal Arrangements
of Phosphatidylcholine Head Groups with Bound
Waters by Molecular Mechanics
Vol.1, No.1, p.39 (1992)
-
Hierarchical structure
-
Development of a Program for Construction of
a Starting Material Library for AIPHOS
Vol.4, No.3, p.101
-
High-spin cobalt(II)
-
Development of MagSaki Software for Magnetic Analysis of Dinuclear High-spin Cobalt(II) Complexes in an Axially Distorted Octahedral Field
Vol.7, No.4, p.171 (2001)
-
HIV protease
-
A Study on Docking Mode of HIV Protease and Their Inhibitors
Vol.7, No.3, p103 (2001)
-
HOMO
-
Electronic State of Anthra[1,9-bc : 4,10-b'c']dichromene
and Structural Analysis of Its Endoperoxide
Vol.3, No.2, p.47 (1996)
-
HOMO-LUMO Energy
-
Development of a Neural Network Simulator for Structure-Activity Correlation of Molecules: Neco (4)
- Sweet / Bitter Classification in Perillartine Derivatives -
Vol.6, No.3, p.115 (2000)
-
How to Increase the Reactivity of Hydroxylmethylation of Tea Catechins?
-A Theoretical Study of the Introduction of a Galloyl Moiety at C-3 Position-
Vol.7, No.2, p.57 (2001)
-
HPr
-
Molecular Dynamics Simulation of Unfolding of Histidine-containing
Phosphocarrier Protein in Water
Vol.4 No.4, (1998)
-
HTML
-
Electronic Publishing of The Journal of Chemical Software
-Integrated Processing of On-line Publishing with Internet and Producing Printed Issues-
Vol.6, No.4, p.145 (2000)
-
HTML type CAL Software
-
Development and the Use of Chemistry Teaching Video Materials by Internet Browser
Vol.4, No.2, p.51 (1997)
-
Human genome
-
Estimation of the Redundancy in Human Genome Shotgun Sequencing by a Monte-Carlo Simulation
Vol.5, No.1,
-
Hydration of carbon dioxide
-
Chemical Reaction Observed with "Computer Microscope"
-Reaction of Water and Carbon Dioxide-
Vol.6, No.2, (2000)
-
Hydrodynamic model
-
Computer Simulation of Hydrodynamic Models for Chemical/Pharmaco-Kinetics
Vol.7, No.2, p79 (2001)
-
Hydrogen atom
-
Visualization of Atomic Orbitals of the Hydrogen Atom
Vol.3, No.1, p.35 (1996)
-
A Combination of Various Visualization Methods of Atomic Orbitals and Representations of Their Wave Character
Vol.8, No.1, p.7 (2002)
-
Hydrogen-deuterium exchange
-
Computational Chemical Prediction for the Position of Hydrogen-Deuterium Exchange in Hydroxyindole Derivatives
Vol.5, No.2
-
Hydrophobic parameter
-
Development of a Neural Network Simulator for Structure-activity Correlation of Molecules: Neco (7)
- Hydrophobic Parameter (logP) Prediction of Perillartine Derivatives -
Vol.8, No.1, p.17 (2002)
-
Hydroxyindole derivatives
-
Computational Chemical Prediction for the Position of Hydrogen-Deuterium Exchange in Hydroxyindole Derivatives
Vol.5, No.2
-
Hydroxylmethylation
-
How to Increase the Reactivity of Hydroxylmethylation of Tea Catechins?
-A Theoretical Study of the Introduction of a Galloyl Moiety at C-3 Position-
Vol.7, No.2, p.57 (2001)
-
I
-
-
Impulsive Force
-
Development of a Neural Network Simulator for Structure-Activity Correlation of Molecules: Neco (6)
- Estimation of Mechanical Properties of Cr-Mo Steel, Ni Steel, Ni-Cr Steel and Ni-Cr-Mo Steel -
Vol.7, No.4, p.179 (2001)
-
Inorganic nomenclature
-
Two Novel Software Programmes for Assisted Learning - Oxidation Numbers and Chemical Nomenclature
Vol.6, No.3, p.105 (2000)
-
Integral Cutoff
-
A Novel Algorithm for Large-Scale Fock Matrix Generation with Small Local Distributed Memory Parallel Architecture.
- Relation to the Integral Cutoff -
Vol.6, No.3, (2000)
-
Interactive
-
Two Novel Software Programmes for Assisted Learning - Oxidation Numbers and Chemical Nomenclature
Vol.6, No.3, p.105 (2000)
-
Interactive animation
-
Interactive Animation of Hydrogen Atomic Orbitals Using QTVR (QuickTime Virtual Reality)
Vol.5, No.3 (1999)
-
Interactive Animation to Facilitate Understanding of the Visual Characteristics of Atomic Orbital Wavefunctions
Vol.7, No.2, p.87 (2001)
-
Interactive education system
-
Convenient Tools Based on a Database Management System for Monitoring Student's Progress in a Self-Learning System Supported by WWW
Vol.7, No.4, p.153 (2001)
-
Interactive Specification of an Atom
-
Development of a Molecular Graphics Program on Sun Workstation(2).
Vol.3, No.2, p.83 (1996)
-
Intermolecular interaction
-
Evaluation of Enthalpies of Benzene-Monosubstituted Benzene interactions by Semi-Empirical MO Calculations.
Their Relationship to the Experimental Enthalpies Determined by GLPC
Vol.5, No.2 (1999)
-
Internet
-
Electronic Publishing of The Journal of Chemical Software
-Integrated Processing of On-line Publishing with Internet and Producing Printed Issues-
Vol.6, No.4, p.145 (2000)
-
Isosurface
-
A Novel Representation of the Angular Part of Atomic Orbitals
Vol.7, No.1, p.29 (2001)
-
A Combination of Various Visualization Methods of Atomic Orbitals and Representations of Their Wave Character
Vol.8, No.1, p.7 (2002)
-
J
-
Java
-
MOLDA for Java - A Platform-independent Molecular Modeling and Molecular Graphics Program Written in the Java Language
Vol.4 No.3, p.81
-
A Trial of a New Lecture System Corresponding to the Era of Network (2)
A Utilization of Java for an Interactive Teaching Aid System
Vol.5, No.1
-
Visualization of Electrochemical Behavior under Finite Conditions using JAVA and its Application for Assisted Learning
Vol.7, No.4, p.145 (2001)
-
Visualization of Electrochemical Measurements under Finite Conditions using JAVA and its Application for Assisted Learning (2)
Vol.8, No.2, p.41 (2002)
-
Development of a Computer-Aided-Education System of Polyhedra
Vol.8, No.2, p.61 (2002)
-
K
-
-
Kekule structure counting
-
Algorithm for Kekule Structure Counting in Fullerene Molecules
Vol.7, No.3, p.99 (2001)
-
KINE
-
Development of 'KINE', a New Software for Time Course Analysis
Vol.5, No.4, p.173 (1999)
-
Kinetics
-
Development of 'KINE', a New Software for Time Course Analysis
Vol.5, No.4, p.173 (1999)
-
L
-
-
Lambda phage DNA
-
Introduction of Physicochemical Properties Termed
Stickiness and Pseudostickiness to Quantification
of Macromolecule-interaction and Its Application to The
Analysis of Lambda Genome DNA
Vol.2, No.2, p.96 (1994)
-
Laminar flow
-
Computer Aided Simulation of Dispersion Theory Based on Experimental Data by Zone Circulating Flow-Injection Analysis
Vol.2, No.1, p.1 (1994)
-
Least squares method
-
Application of U BASIC to Chemical Calculations
Vol.1, No.2, p.99 (1993)
-
Lewis acid site
-
Study of the Interaction of Ethanol with the Broensted and
Lewis Acid Sites on Metal Oxide Surfaces Using the DV-Xa Method
Vol.4 No.2, p.41 (1997)
-
Ligand inhibitor
-
A Study on Docking Mode of HIV Protease and Their Inhibitors
Vol.7, No.3, p103 (2001)
-
Lipid
-
Crystal Structures of Lipids by the Intermolecular Energy Calculation
Vol.3, No.1, p.27 (1996)
-
Local structure
-
Introduction of Physicochemical Properties Termed
Stickiness and Pseudostickiness to Quantification
of Macromolecule-interaction and Its Application to The
Analysis of Lambda Genome DNA
Vol.2, No.2, p.96 (1994)
-
Long-chain base
-
Elucidation of fragmentation pathway of long chain
base by molecular orbital calculation
Vol.3, No.4, p.139 (1997)
-
Lookup table
-
Comparison Algorithm of Protein Sequences by Introducing a Lookup Table
Vol.3, No.3, p.97(1996)
-
Lower Stream
-
Extraction of Chemical Parameter Characterizing the Upper, Middle and Lower Stream by Principal Component Analysis and Neural Network
- The Case of Tamagawa River, Tokyo, Japan -
Vol.8, No.1, p.27 (2002)
-
M
-
-
Macromolecule-interaction
-
Introduction of Physicochemical Properties Termed
Stickiness and Pseudostickiness to Quantification
of Macromolecule-interaction and Its Application to The
Analysis of Lambda Genome DNA
Vol.2, No.2, p.96 (1994)
-
Magnetism
-
Development of MagSaki Software for Magnetic Analysis of Dinuclear High-spin Cobalt(II) Complexes in an Axially Distorted Octahedral Field
Vol.7, No.4, p.171 (2001)
-
MagSaki
-
Development of MagSaki Software for Magnetic Analysis of Dinuclear High-spin Cobalt(II) Complexes in an Axially Distorted Octahedral Field
Vol.7, No.4, p.171 (2001)
-
Matrix Diagonalization
-
Parallel Processing of Molecular Geometry Parameter Optimization by Extended Huckel Method
-An Attempt of Simple Fast Generation of Molecular Structure -
Vol.6, No.2, (2000)
-
Marihuana
-
Discrimination of Marihuana Using Cluster Analysis
Vol.2, No.4, p.220 (1995)
-
Maximal common subgraph
-
Automated Identification of Three-Dimensional Common Structural Features of Proteins
Vol.7, No.4, 161 (2001)
-
Maximum array
-
Comparison Algorithm of Protein Sequences by Introducing a Lookup Table
Vol.3, No.3, p.97(1996)
-
Membrane
-
Crystal Structures of Lipids by the Intermolecular Energy Calculation
Vol.3, No.1, p.27 (1996)
-
Methylviologen
-
Virtual Device Simulator of Bipolar Photogalvanic Cell
Vol.8, No.2, p.47 (2002)
-
Microsoft Visual Basic for MS-DOS
-
Development of A File Conversion Program for Chemical Structure Data: MOLCONV
Vol.3, No.1, p.9 (1996)
-
Middle Stream
-
Extraction of Chemical Parameter Characterizing the Upper, Middle and Lower Stream by Principal Component Analysis and Neural Network
- The Case of Tamagawa River, Tokyo, Japan -
Vol.8, No.1, p.27 (2002)
-
Modification
-
A High Dimensional Optimization Approach Based on Simplex
Method and Its Evaluation by Separation of Overlapped Peaks
Vol.2, No.3, p.159 (1995)
-
MOLCONV
-
Development of A File Conversion Program for Chemical Structure Data: MOLCONV
- Transplantation of the MOLCONV program from PC-9801 for IBM personal computer -
Vol.4, No.3,
-
Molecular dynamics
-
Molecular Dynamics Simulation of Unfolding of Histidine-containing
Phosphocarrier Protein in Water
Vol.4 No.4, (1998)
-
Development of Support Program for AMBER
Vol.5, No.1,
-
Molecular Dynamics Simulation of Biological Molecules (1) Methods
Vol.6 No.1, (2000)
-
Molecular Dynamics Simulation of Biological Molecules (2) Practice
Vol.7, No.1, p.1 (2001)
-
Molecular Dynamics Simulation
-
Display of Molecular Dynamics Simulation Results by MXDORTO with Web Browser
- Interactive and Simple Display Program with GUI -
Vol.7, No.3, p.139 (2001)
-
Molecular Geometry Optimization
-
Parallel Processing of Molecular Geometry Parameter Optimization by Extended Huckel Method
-An Attempt of Simple Fast Generation of Molecular Structure -
Vol.6, No.2, (2000)
-
Molecular graphics
-
Development of an Electronic Picture Book of Molecules.
A Volume of Basic Organic Compounds
Vol.1, No.3,4, p.183 (1993)
-
Development of an Electronic Picture Book of Molecules. IV
A Volume of Biologically Active Substances
Vol.2, No.4, p.206 (1995)
-
Development of a Molecular Graphics Program on Sun Workstation(2).
Vol.3, No.2, p.83 (1996)
-
MOLDA for Windows - A Molecular Modeling and Molecular Graphics Program
Using a VRML Viewer on Personal Computers
Vol.3, No.4, p.147(1997)
-
CyberMol - A Molecular Graphics Program System on
the World Wide Web Using the Common Gateway Interface
Vol.3, No.4, p.157(1997)
-
Development of a Display and Retrieval System for the Protein Data Bank on Sun Microsystems Workstation
Vol.4, No.1, p.1 (1997)
-
MOLDA for Java - A Platform-independent Molecular Modeling and Molecular Graphics Program Written in the Java Language
Vol.4 No.3, p.81
-
A Display of Biopolymer Using Virtual Reality Modeling Language
Vol.4, No.4,
-
Development of Support Program for AMBER
Vol.5, No.1,
-
A Molecular Graphics Program by Using the OpenGL Routine
Vol.6, No.4, p.157(2000)
-
Molecular mechanics
-
Conformational Analysis of Hexagonal Arrangements
of Phosphatidylcholine Head Groups with Bound
Waters by Molecular Mechanics
Vol.1, No.1, p.39 (1992)
-
Crystal Structures of Lipids by the Intermolecular Energy Calculation
Vol.3, No.1, p.27 (1996)
-
Molecular modeling
-
Development of an Electronic Picture Book of Molecules.
A Volume of Basic Organic Compounds
Vol.1, No.3,4, p.183 (1993)
-
Crystal Structures of Lipids by the Intermolecular Energy Calculation
Vol.3, No.1, p.27 (1996)
-
MOLDA for Windows - A Molecular Modeling and Molecular Graphics Program
Using a VRML Viewer on Personal Computers
Vol.3, No.4, p.147(1997)
-
MOLDA for Java - A Platform-independent Molecular Modeling and Molecular Graphics Program Written in the Java Language
Vol.4 No.3, p.81
-
Development of Support Program for AMBER
Vol.5, No.1,
-
Molecular orbital
-
Electronic State of Anthra[1,9-bc : 4,10-b'c']dichromene
and Structural Analysis of Its Endoperoxide
Vol.3, No.2, p.47 (1996)
-
Molecular orbital calculation
-
Elucidation of fragmentation pathway of long chain
base by molecular orbital calculation
Vol.3, No.4, p.139 (1997)
-
Molecular orbital method
-
Correlation Between the Thermodynamic Functions of Molecular Inclusion of Monohydric Alcohols into Cyclodextrin and Their Molecular Surface Areas
Vol.8, No.1, p.1 (2002)
-
Molecular recognition
-
Correlation Between the Thermodynamic Functions of Molecular Inclusion of Monohydric Alcohols into Cyclodextrin and Their Molecular Surface Areas
Vol.8, No.1, p.1 (2002)
-
Molecular structure
-
Development of an Electronic Picture Book of Molecules. IV
A Volume of Biologically Active Substances
Vol.2, No.4, p.206 (1995)
-
Development of a Molecular Graphics Program on Sun Workstation.
Vol.2, No.4, p.212 (1995)
-
Development of a CAI Program Utilizing Spreadsheet Data Files and a Collection of Data
Vol.4, No.1, p.11 (1997)
-
Molten globule state
-
Molecular Dynamics Simulation of Unfolding of Histidine-containing
Phosphocarrier Protein in Water
Vol.4 No.4, (1998)
-
Monte-Carlo simulation
-
Estimation of the Redundancy in Human Genome Shotgun Sequencing by a Monte-Carlo Simulation
Vol.5, No.1,
-
Monte Carlo method
-
Crystal Structure Model-Assembly Program Using the Monte Carlo and the R-factor Method
Vol.5, No.4, p.163 (1999)
-
MOPAC
-
Photochromism and Structural Chemistry of
Benzo[1,2,3-kl : 4,5,6-k'l']dixanthene and its analogues
Vol.2, No.1, p.25 (1994)
-
Electronic State of Anthra[1,9-bc : 4,10-b'c']dichromene
and Structural Analysis of Its Endoperoxide
Vol.3, No.2, p.47 (1996)
-
Chemical Reaction Observed with "Computer Microscope"
-Reaction of Water and Carbon Dioxide-
Vol.6, No.2, (2000)
-
MOPAC93
-
Evaluation of Enthalpies of Benzene-Monosubstituted Benzene interactions by Semi-Empirical MO Calculations.
Their Relationship to the Experimental Enthalpies Determined by GLPC
Vol.5, No.2,
-
Mouse subroutine
-
Programming of a Graphic Software Composed of
a Set of Mouse-subroutines for Chemical Education
Vol.1, No.3,4 p.177 (1993)
-
MS-DOS
-
Porting UNICS$B-7(B, the Computation System for X-ray Crystal Structure Analysis, to the Personal Computer and the Engineering Workstation
Vol.2, No.3, p.167 (1995)
-
Development of A File Conversion Program for Chemical Structure Data: MOLCONV
- Transplantation of the MOLCONV program from PC-9801 for IBM personal computer -
Vol.4, No.3,
-
Development of Band-Shape Analysis with GUI
Vol.6, No.2, (2000)
-
MS Windows
-
Porting UNICS$B-7(B, the Computation System for X-ray Crystal Structure Analysis, to the Personal Computer and the Engineering Workstation
Vol.2, No.3, p.167 (1995)
-
Multi-dimensional Ck Interpolation Scheme
-
Estimation of Elution Induce Time and 80% Elution Time of Polymer-Coated Manure by a Neural Network and Ck Interpolation Scheme
- Development of a Neural Network Simulator for Structure-Activity Correlation of Molecules: Neco (5) -
Vol.7, No.3, p.115 (2001)
-
Multi-Layered Cyclic Fence Graph
-
Development of Graphical Characteristics Data Base : GCDB
-Graphical Characteristics of Multi-Layered Cyclic Fence Graph-
Vol.5, No.4, p.137 (1999)
-
Multimedia
-
Development of Software for Chemical Education Using Multimedia Techniques
Vol.3, No.2, p.73 (1996)
-
Multiple Roots
-
A Simple Algorithm to Solve Non-linear Equations with Multiple Roots of Two Variables Appearing in Autocatalytic Reaction in Open Systems
Vol.5, No.2
-
Multivariate Regression Analysis
-
Simultaneous Fluorometric Determination of Polycyclic Aromatic Hydrocarbons by Multivariate Regression Analysis
Vol.3, No.2, p.65 (1996)
-
MXDORTO
-
Display of Molecular Dynamics Simulation Results by MXDORTO with Web Browser
- Interactive and Simple Display Program with GUI -
Vol.7, No.3, p.139 (2001)
N-Z