Dendral and meta-dendral

Mass spectrometry in structural and stereochemical problems

1975 • 307 citations

On generality and problem solving: a case study using the DENDRAL program

1970 • 191 citations

Applications of artificial intelligence for chemical inference. I. Number of possible organic compounds. Acyclic structures containing carbon, hydrogen, oxygen, and nitrogen

1969 • 165 citations

MODEL-DIRECTED LEARNING OF PRODUCTION RULES11This work was supported by the Advanced Research Projects Agency under contract DAHC 15-73-C-0435, and by the National Institutes of Health under grant RR 00612–07.

1978 • 156 citations

Heuristic DENDRAL: A Program for Generating Explanatory Hypotheses in Organic Chemistry

1969 • 147 citations

Extraction of mass spectra free of background and neighboring component contributions from gas chromatography/mass spectrometry data

1976 • 137 citations

Model-directed learning of production rules

1977 • 110 citations

Applications of artificial intelligence for chemical inference. XVII. Approach to computer-assisted elucidation of molecular structure

1975 • 101 citations

Applications of artificial intelligence for chemical inference. 22. Automatic rule formation in mass spectrometry by means of the meta-DENDRAL program

1976 • 101 citations

Applications of artificial intelligence for chemical inference. II. Interpretation of low-resolution mass spectra of ketones

1969 • 81 citations

Applications of artificial intelligence for chemical inference. XII. Exhaustive generation of cyclic and acyclic isomers

1974 • 74 citations

Applications of artificial intelligence for chemical inference—XXI

1976 • 58 citations

TOPOLOGICAL MAPPING OF ORGANIC MOLECULES

1965 • 57 citations

Applications of artificial intelligence for chemical inference. III. Aliphatic ethers diagnosed by their low-resolution mass spectra and nuclear magnetic resonance data

1969 • 52 citations

Applications of “Artificial Intelligence” for Chemical Inference, VI. Approach to a General Method of Interpreting Low Resolution Mass Spectra with a Computer

1970 • 48 citations

Applications of artificial intelligence for chemical inference. VIII. Approach to the computer interpretation of the high resolution mass spectra of complex molecules. Structure elucidation of estrogenic steroids

1972 • 47 citations

Constructive graph labeling using double cosets

1974 • 36 citations

ARTIFICIAL INTELLIGENCE: THEMES IN THE SECOND DECADE

1968 • 35 citations

Applications of artificial intelligence for chemical inference—X

1973 • 33 citations

Applications of artificial intelligence for chemical inference. IV. Saturated amines diagnosed by their low resolution mass spectra and nuclear magnetic resonance spectra

1970 • 33 citations

A heuristic programming study of theory formation in science

1971 • 32 citations

Applications of artificial intelligence for chemical inference. XIII. Labeling of objects having symmetry

1974 • 32 citations

The Heuristic DENDRAL program for explaining empirical data

1971 • 32 citations

Computer-assisted structure manipulation

1978 • 30 citations

Applications of artificial intelligence for chemical inference. I - The number of possible organic compounds - Acyclic structures containing C, H, O, and N.

1969 • 29 citations

Application of artificial intelligence for chemical inference. XXV. A computer program for automated empirical ¹³C NMR rule formation

1978 • 29 citations

An algorithm for the construction of the graphs of organic molecules

1974 • 26 citations

Applications of artificial intelligence for chemical inference. IX. Analysis of mixtures without prior separation as illustrated for estrogens

1973 • 25 citations

Hamilton Circuits of Convex Trivalent Polyhedra (Up to 18 Vertices)

1967 • 24 citations

Applications of artificial intelligence for chemical inference. Part XI. Analysis of carbon-13 nuclear magnetic resonance data for structure elucidation of acyclic amines

1973 • 23 citations

On the Design of Inductive Systems: Some Philosophical Problems

1969 • 19 citations

Structural isomerism of mono- and sesquiterpenoid skeletons

1976 • 19 citations

Mass spectrometry in structural and stereochemical problems—CCXLIV

1975 • 18 citations

A Model-Based Approach to the Teletype Printing of Chemical Structures

1976 • 17 citations

Mechanization of inductive inference in organic chemistry.

1967 • 17 citations

The Scope of Structural Isomerism

1975 • 16 citations

Applications of artificial intelligence for chemical inference—V. An approach to the computer generation of cyclic structures. Differentiation between all the possible isomeric ketones of compositon C6H10O

1970 • 16 citations

Topology of Molecules

1969 • 14 citations

Applications of artificial intelligence for chemical inference. XV. Constructive graph labeling applied to chemical problems. Chlorinated hydrocarbons

1975 • 10 citations

Rapid calculation of molecular formulas from mass values

1972 • 10 citations

Applications of artificial intelligence for chemical inference—XX

1977 • 9 citations

Applications of artificial intelligence for chemical inference. XIX—Computer generation of ion structures

1976 • 9 citations

A Heuristic Program for Solving a Scientific Inference Problem: Summary of Motivation and Implementation

1970 • 9 citations

Networking and a Collaborative Research Community: a Case Study Using the DENDRAL Programs

1975 • 9 citations

Errata- Applications of Artificial Intelligence for Chemical Inference. XVI. Computer Generation of Vertex-Graphs and Ring Systems

1976 • 8 citations

Mass spectrometry in structural and stereochemical problems. CCLVI—electron impact induced fragmentation of juvenile hormone analogs

1976 • 7 citations

An application of artificial intelligence to the interpretation of mass spectra.

1971 • 7 citations

ChemInform Abstract: APPLICATION OF ARTIFICIAL INTELLIGENCE FOR CHEMICAL INFERENCE PART 14, A GENERAL METHOD FOR PREDICTING MOLECULAR IONS IN MASS SPECTRA

1975 • 6 citations

Computer-Assisted Structure Elucidation: Modelling Chemical Reaction Sequences Used in Molecular Structure Problems

1977 • 5 citations

Systematics of organic molecules, graph topology and Hamilton circuits. A general outline of the Dendral system Interim report

1966 • 5 citations

Structure Elucidation Based on Computer Analysis of High and Low Resolution Mass Spectral Data

1978 • 4 citations

Computer Assisted Chemical Reasoning

1977 • 3 citations

[Remarks on "Online Computation of Molecular Formulas from Mass Number"]

1968 • 2 citations