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Efficient Application of 2D NMR Correlation Information in Computer-Assisted Structure Elucidation of Complex Natural Products
Coding Chemical Trees with the Centered N-tuple Code
Frequency of even and odd numbers in distance matrixes of bipartite graphs
GraphPad InPlot
Calculating the cell polynomial of catacondensed polycyclic hydrocarbons. [Erratum to document cited in CA120:190658]
Computer-Assisted Mechanistic Evaluation of Organic Reactions. 25. Structure Diagram Positioning
Comparison of Automatic Three-Dimensional Model Builders Using 639 X-ray Structures
Automatic extraction of ring substructures from a chemical structure. [Erratum to document cited in CA120:76588]
Structural similarity searching using descriptors developed for structure-activity relationship studies. [Erratum to document cited in CA117:233063]
Quick Method for Anti-Bredt Structure Detection
A new scheme for assignment of a canonical connection table
Structure-Activity Study on Antiviral 5-Vinylpyrimidine Nucleoside Analogs Using Wiener's Topological Index
Mono-Q-Polyhexes with Q Larger than 6: Polygonal Systems Representing a Class of Polycyclic Conjugated Hydrocarbons
Prime Number Assignment to a Hexagonal Tessellation of a Plane That Generates Canonical Names for Peri-Condensed Polybenzenes
Rule induction for systems predicting biological activity. [Erratum to document cited in CA120:76590]
AMPAC 4.5
Computer Application of an Incremental System for Calculating 13C NMR Spectra of Aromatic Compounds
SpecTool
On a Graph Theoretical Characterization of Cis/Trans Isomers
A Novel Definition of the Hyper-Wiener Index for Cycles
Online User Needs in Chemical Information
A novel algorithm for local minimum escape in back-propagation neural networks: application to the interpretation of matrix isolation infrared spectra
Review of Lotus 123 Release 4 for Windows
An efficient approach toward a flexible and general knowledge definition and program control language system for a synthesis-planning program
Application of the Maximal Common Substructure Algorithm to Automatic Interpretation of 13C-NMR Spectra
Prediction of boiling points and critical temperatures of industrially important organic compounds from molecular structure
Application of automated structure analysis to some organic compounds using PCs. 3. Crystallographic programs
List Operations on Chemical Graphs. 5. Implementation of Breadth-First Molecular Path Generation and Application in the Estimation of Retention Index Data and Boiling Points
SYMBEQ Program and Its Application in Computer-Assisted Reaction Design
Applications of High-Resolution Self-Organizing Maps to Retrosynthetic and QSAR Analysis
Inferring Extended Virtual Knowledge from an EPIOS Conversion Graph of Overlapping Substructures
Heuristics for systematic elucidation of reaction pathways
A Proposed Common Spatial Pharmacophore and the Corresponding Active Conformations of Some TxA2 Receptor Antagonists
Introduction of NOE data to an automated structure elucidation system, CHEMICS. Three-dimensional structure elucidation using the distance geometry method
Neural Network-Graph Theory Approach to the Prediction of the Physical Properties of Organic Compounds
Application of Genetic Function Approximation to Quantitative Structure-Activity Relationships and Quantitative Structure-Property Relationships
Computer-assisted synthetic analysis. Performance of tactical combinations of transforms
Efficient exact solution of the ring perception problem
Semantic dictionary for substructure matching of chemical structures with general descriptors
Computer Automated log P Calculations Based on an Extended Group Contribution Approach
Using Polynomial Smoothing and Data Bounding for the Detection of Adverse Process Changes in a Chemical Process
Computer-assisted synthetic analysis. A generalized procedure for subgoal transform selection based on a two-dimensional pattern language
Application of a digital 1H-NMR spectrum to the survival test of substructures and the assignment test
Application of Expert System CISOC-SES to the Structure Elucidation of Complex Natural Products
Bit-tuple Notation for Trees
Distance Matrixes Yielding Angles between Arcs of the Graphs
Messenger and S4: A Comparison of Structure Search Systems
ESSESA: An Expert System for Structure Elucidation from Spectra. 4. Canonical Representation of Structures
Standard Genetic Code Degeneracies from Maximum Information Calculations
Evaluation of Two Procedures for Selecting Starting Conformations for Energy Minimization of Peptides
Book Reviews: Neutral Computing: An Introduction
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