Peter Willett
Orcid: 0000-0003-4591-7173Affiliations:
- The University of Sheffield, UK
According to our database1,
Peter Willett
authored at least 239 papers
between 1978 and 2024.
Collaborative distances:
Collaborative distances:
Timeline
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Online presence:
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on orcid.org
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on id.loc.gov
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on shef.ac.uk
On csauthors.net:
Bibliography
2024
J. Cheminformatics, December, 2024
Scholarly communication between health informatics and information systems: A bibliometric study.
Health Informatics J., 2024
2022
J. Cheminformatics, 2022
2020
2019
Identification of research communities in cited and uncited publications using a co-authorship network.
Scientometrics, 2019
Motivations, understandings, and experiences of open-access mega-journal authors: Results of a large-scale survey.
J. Assoc. Inf. Sci. Technol., 2019
2018
Academic communities: The role of journals and open-access mega-journals in scholarly communication.
J. Documentation, 2018
"Let the community decide"? The vision and reality of soundness-only peer review in open-access mega-journals.
J. Documentation, 2018
2017
Transitioning from a Conventional to a 'Mega' Journal: A Bibliometric Case Study of the Journal <i>Medicine</i>.
Publ., 2017
Learn. Publ., 2017
Learn. Publ., 2017
Open-access mega-journals: The future of scholarly communication or academic dumping ground? A review.
J. Documentation, 2017
2015
J. Chem. Inf. Model., 2015
J. Chem. Inf. Model., 2015
Aslib J. Inf. Manag., 2015
Proceedings of the Experimental IR Meets Multilinguality, Multimodality, and Interaction, 2015
2014
COGNAC: a web server for searching and annotating hydrogen-bonded base interactions in RNA three-dimensional structures.
Nucleic Acids Res., 2014
J. Documentation, 2014
The use of 2D fingerprint methods to support the assessment of structural similarity in orphan drug legislation.
J. Cheminformatics, 2014
2013
IMAAAGINE: a webserver for searching hypothetical 3D amino acid side chain arrangements in the Protein Data Bank.
Nucleic Acids Res., 2013
Quantifying the value of knowledge exports from librarianship and information science research.
J. Inf. Sci., 2013
Comparison of chemical similarity measures using different numbers of query structures.
J. Inf. Sci., 2013
Proceedings of the 13th IEEE International Conference on BioInformatics and BioEngineering, 2013
2012
SPRITE and ASSAM: web servers for side chain 3D-motif searching in protein structures.
Nucleic Acids Res., 2012
NASSAM: a server to search for and annotate tertiary interactions and motifs in three-dimensional structures of complex RNA molecules.
Nucleic Acids Res., 2012
Similarity Coefficients for Binary Chemoinformatics Data: Overview and Extended Comparison Using Simulated and Real Data Sets.
J. Chem. Inf. Model., 2012
J. Comput. Aided Mol. Des., 2012
Interactions Between Weighting Scheme and Similarity Coefficient in Similarity-Based Virtual Screening.
Int. J. Chemoinformatics Chem. Eng., 2012
2011
Similarity-based data mining in files of two-dimensional chemical structures using fingerprint measures of molecular resemblance.
WIREs Data Mining Knowl. Discov., 2011
Comments on "On Bibliometric Analysis of Chinese Research on Cyclization, MALDI-TOF, and Antibiotics: Methodological Concerns".
J. Chem. Inf. Model., 2011
Multiple search methods for similarity-based virtual screening: analysis of search overlap and precision.
J. Cheminformatics, 2011
Novel base triples in RNA structures revealed by graph theoretical searching methods.
BMC Bioinform., 2011
Aslib Proc., 2011
Proceedings of the Current Challenges in Patent Information Retrieval, 2011
2010
Ranking of library and information science researchers: Comparison of data sources for correlating citation data, and expert judgments.
J. Informetrics, 2010
Lead Optimization Using Matched Molecular Pairs: Inclusion of Contextual Information for Enhanced Prediction of hERG Inhibition, Solubility, and Lipophilicity.
J. Chem. Inf. Model., 2010
Bibliometric Analysis of Chinese Research on Cyclization, MALDI-TOF, and Antibiotics.
J. Chem. Inf. Model., 2010
The <i>Journal of Chemical Documentation</i> and the <i>Journal of Chemical Information and Computer Sciences</i>: Publication and Citation Statistics.
J. Chem. Inf. Model., 2010
J. Chem. Inf. Model., 2010
A Power-Enhanced Algorithm for Spatial Anomaly Detection in Binary Labelled Point Data Using the Spatial Scan Statistic.
Proceedings of the Knowledge-Based and Intelligent Information and Engineering Systems, 2010
2009
Turbo similarity searching: Effect of fingerprint and dataset on virtual-screening performance.
Stat. Anal. Data Min., 2009
Webometric analysis of departments of librarianship and information science: a follow-up study.
J. Inf. Sci., 2009
J. Chem. Inf. Model., 2009
J. Chem. Inf. Model., 2009
Use of Reduced Graphs To Encode Bioisosterism for Similarity-Based Virtual Screening.
J. Chem. Inf. Model., 2009
J. Cheminformatics, 2009
J. Comput. Aided Mol. Des., 2009
ArticleRank: a PageRank-based alternative to numbers of citations for analysing citation networks.
Aslib Proc., 2009
Algorithms, 2009
Enhancing the Effectiveness of Fingerprint-Based Virtual Screening: Use of Turbo Similarity Searching and of Fragment Frequencies of Occurrence.
Proceedings of the Pattern Recognition in Bioinformatics, 2009
2008
From chemical documentation to chemoinformatics: 50 years of chemical information science.
J. Inf. Sci., 2008
Structure and singly occupied molecular orbital analysis of anionic tautomers of guanine.
J. Comput. Chem., 2008
2007
Representing Clusters Using a Maximum Common Edge Substructure Algorithm Applied to Reduced Graphs and Molecular Graphs.
J. Chem. Inf. Model., 2007
J. Chem. Inf. Model., 2007
J. Comput. Aided Mol. Des., 2007
Proceedings of the Pattern Recognition and Image Analysis, Third Iberian Conference, 2007
2006
Brief communication: Gender differences in publication and citation counts in librarianship and information science research.
J. Inf. Sci., 2006
J. Chem. Inf. Model., 2006
J. Chem. Inf. Model., 2006
J. Chem. Inf. Model., 2006
Similarity Searching in Databases of Flexible 3D Structures Using Autocorrelation Vectors Derived from Smoothed Bounded Distance Matrices.
J. Chem. Inf. Model., 2006
Knowledge-Based Interaction Fingerprint Scoring: A Simple Method for Improving the Effectiveness of Fast Scoring Functions.
J. Chem. Inf. Model., 2006
New Methods for Ligand-Based Virtual Screening: Use of Data Fusion and Machine Learning to Enhance the Effectiveness of Similarity Searching.
J. Chem. Inf. Model., 2006
Genomic Data Analysis Using DNA Structure: An Analysis of Conserved Nongenic Sequences and Ultraconserved Elements.
J. Chem. Inf. Model., 2006
Virtual Screening Using Binary Kernel Discrimination: Effect of Noisy Training Data and the Optimization of Performance.
J. Chem. Inf. Model., 2006
Unsupervised 3D Ring Template Searching as an Ideas Generator for Scaffold Hopping: Use of the LAMDA, RigFit, and Field-Based Similarity Search (FBSS) Methods.
J. Chem. Inf. Model., 2006
J. Chem. Inf. Model., 2006
GALAHAD: 1. Pharmacophore identification by hypermolecular alignment of ligands in 3D.
J. Comput. Aided Mol. Des., 2006
Identification of target-specific bioisosteric fragments from ligand-protein crystallographic data.
J. Comput. Aided Mol. Des., 2006
2005
J. Chem. Inf. Model., 2005
Graph theoretic methods for the analysis of structural relationships in biological macromolecules.
J. Assoc. Inf. Sci. Technol., 2005
Research Paper: Use of Graph Theory to Identify Patterns of Deprivation and High Morbidity and Mortality in Public Health Data Sets.
J. Am. Medical Informatics Assoc., 2005
2004
Enhancing the Effectiveness of Virtual Screening by Fusing Nearest Neighbor Lists: A Comparison of Similarity Coefficients.
J. Chem. Inf. Model., 2004
Clustering Files of Chemical Structures Using the Fuzzy <i>k</i>-Means Clustering Method.
J. Chem. Inf. Model., 2004
Comparison of Fingerprint-Based Methods for Virtual Screening Using Multiple Bioactive Reference Structures.
J. Chem. Inf. Model., 2004
Proceedings of the SIGIR 2004: Proceedings of the 27th Annual International ACM SIGIR Conference on Research and Development in Information Retrieval, 2004
Proceedings of the 43rd IEEE Conference on Decision and Control, 2004
2003
Chemoinformatics Research at the University of Sheffield: A History and Citation Analysis.
J. Inf. Sci., 2003
J. Chem. Inf. Comput. Sci., 2003
Evaluation of Similarity Measures for Searching the Dictionary of Natural Products Database.
J. Chem. Inf. Comput. Sci., 2003
J. Chem. Inf. Comput. Sci., 2003
J. Chem. Inf. Comput. Sci., 2003
J. Chem. Inf. Comput. Sci., 2003
Similarity Searching in Databases of Flexible 3D Structures Using Smoothed Bounded Distance Matrices.
J. Chem. Inf. Comput. Sci., 2003
J. Chem. Inf. Comput. Sci., 2003
J. Chem. Inf. Comput. Sci., 2003
J. Chem. Inf. Comput. Sci., 2003
Representation, searching and discovery of patterns of bases in complex RNA structures.
J. Comput. Aided Mol. Des., 2003
Protein Structures and Information Extraction from Biological Texts: The PASTA System.
Bioinform., 2003
2002
Heuristics for Similarity Searching of Chemical Graphs Using a Maximum Common Edge Subgraph Algorithm.
J. Chem. Inf. Comput. Sci., 2002
J. Chem. Inf. Comput. Sci., 2002
Maximum common subgraph isomorphism algorithms for the matching of chemical structures.
J. Comput. Aided Mol. Des., 2002
Effectiveness of graph-based and fingerprint-based similarity measures for virtual screening of 2D chemical structure databases.
J. Comput. Aided Mol. Des., 2002
Comput. J., 2002
2001
Calculating the knowledge-based similarity of functional groups using crystallographic data.
J. Comput. Aided Mol. Des., 2001
Intelligent Access to Text: Integrating Information Extraction Technology into Text Browsers.
Proceedings of the First International Conference on Human Language Technology Research, 2001
2000
J. Inf. Sci., 2000
Similarity Searching in Files of Three-Dimensional Chemical Structures: Analysis of the BIOSTER Database Using Two-Dimensional Fingerprints and Molecular Field Descriptors.
J. Chem. Inf. Comput. Sci., 2000
J. Chem. Inf. Comput. Sci., 2000
J. Chem. Inf. Comput. Sci., 2000
Evaluation of the EVA descriptor for QSAR studies: 3. The use of a genetic algorithm to search for models with enhanced predictive properties (EVA_GA).
J. Comput. Aided Mol. Des., 2000
Textual and chemical information processing: different domains but similar algorithms.
Inf. Res., 2000
1999
Follow-up study of graduates from the MSc Information Management programme at the University of Sheffield.
J. Inf. Sci., 1999
J. Chem. Inf. Comput. Sci., 1999
J. Comput. Biol., 1999
Evaluation of a novel molecular vibration-based descriptor (EVA) for QSAR studies: 2. Model validation using a benchmark steroid dataset.
J. Comput. Aided Mol. Des., 1999
ACM Comput. Surv., 1999
Proceedings of the Third Annual International Conference on Research in Computational Molecular Biology, 1999
1998
Identification of Biological Activity Profiles Using Substructural Analysis and Genetic Algorithms.
J. Chem. Inf. Comput. Sci., 1998
Comput. J., 1998
1997
Lab Report Special Section: Information Retrieval Research in the University of Sheffield.
SIGIR Forum, 1997
Comput. Humanit., 1997
J. Chem. Inf. Comput. Sci., 1997
Similarity Searching in Files of Three-Dimensional Chemical Structures: Evaluation of the EVA Descriptor and Combination of Rankings Using Data Fusion.
J. Chem. Inf. Comput. Sci., 1997
The Effectiveness of Reactant Pools for Generating Structurally-Diverse Combinatorial Libraries.
J. Chem. Inf. Comput. Sci., 1997
Evaluation of a novel infrared range vibration-based descriptor (EVA) for QSAR studies. 1. General application.
J. Comput. Aided Mol. Des., 1997
Similarity searching in files of three-dimensional chemical structures: Representation and searching of molecular electrostatic potentials using field-graphs.
J. Comput. Aided Mol. Des., 1997
J. Comput. Aided Mol. Des., 1997
1996
An Upperbound to the Performance of Ranked-output Searching: Optimal Weighting of Query Terms using a Genetic Algorithm.
J. Documentation, 1996
Similarity Searching in Files of Three-Dimensional Chemical Structures. Alignment of Molecular Electrostatic Potential Fields with a Genetic Algorithm.
J. Chem. Inf. Comput. Sci., 1996
Similarity Searching in Files of Three-Dimensional Chemical Structures: Flexible Field-Based Searching of Molecular Electrostatic Potentials.
J. Chem. Inf. Comput. Sci., 1996
On the Creation of Hypertext Links in Full-Text Documents: Measurement of Retrieval Effectiveness.
J. Am. Soc. Inf. Sci., 1996
1995
A survey of hypertext-based public-access point-of information systems in UK libraries.
J. Inf. Sci., 1995
Response to Comment on "The Extent of the Relationship between the Graph-Theoretical and the Geometrical Shape Coefficients of Chemical Compounds".
J. Chem. Inf. Comput. Sci., 1995
The Extent of the Relationship between the Graph-Theoretical and the Geometrical Shape Coefficients of Chemical Compounds.
J. Chem. Inf. Comput. Sci., 1995
Angular Spectroscopy: Rapid Visualization of Three-Dimensional Substructure Dissimilarity Using Valence Angle or Torsional Descriptors.
J. Chem. Inf. Comput. Sci., 1995
J. Comput. Aided Mol. Des., 1995
1994
J. Documentation, 1994
On the Creation of Hypertext Links in Full-Text Documents: Measurement of Inter-Linker Consistency.
J. Documentation, 1994
Similarity searching in files of three-dimensional chemical structures. Implementation of atom mapping on the distributed array processor DAP-610, the MasPar MP-1104, and the connection machine CM-200.
J. Chem. Inf. Comput. Sci., 1994
Similarity Searching and Clustering of Chemical-Structure Databases Using Molecular Property Data.
J. Chem. Inf. Comput. Sci., 1994
Pharmacophoric pattern matching in files of three-dimensional chemical structures: Comparison of conformational-searching algorithms for flexible searching.
J. Chem. Inf. Comput. Sci., 1994
J. Chem. Inf. Comput. Sci., 1994
Hyperstructure model for chemical structure handling: Techniques for substructure searching.
J. Chem. Inf. Comput. Sci., 1994
Similarity searching in files of three-dimensional chemical structures: Comparison of fragment-based measures of shape similarity.
J. Chem. Inf. Comput. Sci., 1994
Identification of .beta.-sheet motifs, of .psi.-loops, and of patterns of amino acid residues in three-dimensional protein structures using a subgraph-isomorphism algorithm.
J. Chem. Inf. Comput. Sci., 1994
On the Measurement of Inter-Linker Consistency and Retrieval Effectiveness in Hypertext Databases.
Proceedings of the 17th Annual International ACM-SIGIR Conference on Research and Development in Information Retrieval. Dublin, 1994
1993
Inf. Process. Manag., 1993
Searching Databases of Two-Dimensional and Three-Dimensional Chemical Structures Using Genetic Algorithms.
Proceedings of the 5th International Conference on Genetic Algorithms, 1993
1992
J. Inf. Sci., 1992
A publication and citation analysis of the Department of Information Studies, University of Sheffield, 1980-1990.
J. Inf. Sci., 1992
Hyperstructure model for chemical structure handling: generation and atom-by-atom searching of hyperstructures.
J. Chem. Inf. Comput. Sci., 1992
J. Chem. Inf. Comput. Sci., 1992
J. Am. Soc. Inf. Sci., 1992
Searching for Historical Word-Forms in a Database of 17th-Century English Text Using Spelling-Correction Methods.
Proceedings of the 15th Annual International ACM SIGIR Conference on Research and Development in Information Retrieval. Copenhagen, 1992
1991
Searching for Historical Word Forms in Text Databases using Spelling-Correction Methods: Reverse error and phonetic coding Methods.
J. Documentation, 1991
Atom-by-atom searching using massive parallelism. Implementation of the Ullmann subgraph isomorphism algorithm on the distributed array processor.
J. Chem. Inf. Comput. Sci., 1991
Techniques for the calculation of three-dimensional structural similarity using inter-atomic distances.
J. Comput. Aided Mol. Des., 1991
The limitations of term co-occurrence data for query expansion in document retrieval systems.
J. Am. Soc. Inf. Sci., 1991
Inf. Process. Manag., 1991
Nearest-neighbour Searching in Files of Text Signatures Using Transputer Networks.
Electron. Publ., 1991
1990
Proceedings of the SIGIR'90, 1990
1989
J. Inf. Sci., 1989
J. Inf. Sci., 1989
J. Inf. Sci., 1989
Efficiency of Hierarchic Agglomerative Clustering using the ICL Distributed array Processor.
J. Documentation, 1989
J. Documentation, 1989
Upperbound procedures for the identification of similar three-dimensional chemical structures.
J. Comput. Aided Mol. Des., 1989
Inf. Process. Manag., 1989
Comput. J., 1989
1988
Parallel Comput., 1988
Efficiency of text scanning in bibliographic databases using microprocessor-based, multiprocessor networks.
J. Inf. Sci., 1988
J. Am. Soc. Inf. Sci., 1988
Inf. Process. Manag., 1988
Inf. Process. Manag., 1988
Paragraph-based Searching in Full-Text Documents.
Electron. Publ., 1988
1987
Parallel Comput., 1987
Information retrieval research in the Department of Information Studies, University of Sheffield: 1965-1985.
J. Inf. Sci., 1987
J. Inf. Sci., 1987
Nearest Neighbour Searching in Binary Search Trees: Simulation of a Multiprocessor System.
J. Documentation, 1987
J. Chem. Inf. Comput. Sci., 1987
Current research into chemical and textual information retrieval at the department of information studies, University of Sheffield.
Inf. Process. Manag., 1987
Proceedings of the Tenth Annual International ACM SIGIR Conference on Research and Development in Information Retrieval, 1987
1986
Implementation of nonhierarchic cluster analysis methods in chemical information systems: selection of compounds for biological testing and clustering of substructure search output.
J. Chem. Inf. Comput. Sci., 1986
Implementation of nearest-neighbor searching in an online chemical structure search system.
J. Chem. Inf. Comput. Sci., 1986
Computer storage and retrieval of generic chemical structures in patents. 7. Parallel simulation of a relaxation algorithm for chemical substructure search.
J. Chem. Inf. Comput. Sci., 1986
J. Am. Soc. Inf. Sci., 1986
Criteria for the Selection of Search Strategies in Best-Match Document-Retrieval Systems.
Int. J. Man Mach. Stud., 1986
Proceedings of the SIGIR'86, 1986
1985
Inf. Process. Manag., 1985
1984
J. Documentation, 1984
Evaluation of relocation clustering algorithms for the automatic classification of chemical structures.
J. Chem. Inf. Comput. Sci., 1984
A note on the use of nearest neighbors for implementing single linkage document classifications.
J. Am. Soc. Inf. Sci., 1984
1983
J. Chem. Inf. Comput. Sci., 1983
Inf. Process. Manag., 1983
1982
J. Am. Soc. Inf. Sci., 1982
J. Am. Soc. Inf. Sci., 1982
1981
Use of a maximum common subgraph algorithm in the automatic identification of ostensible bond changes occurring in chemical reactions.
J. Chem. Inf. Comput. Sci., 1981
Evaluation and implementation of topological codes for online compound search and registration.
J. Chem. Inf. Comput. Sci., 1981
Method for generating a chemical reaction index for storage and retrieval of information. Comments.
J. Chem. Inf. Comput. Sci., 1981
A fast procedure for the calculation of similarity coefficients in automatic classification.
Inf. Process. Manag., 1981
1980
The Evaluation of an Automatically Indexed, Machine-Readable Chemical Reactions File.
J. Chem. Inf. Comput. Sci., 1980
J. Am. Soc. Inf. Sci., 1980
1979
Document Retrieval Experiments using Indexing Vocabularies of varying Size. I. Variety Generation Symbols Assigned to the Fronts of Index Terms.
J. Documentation, 1979
Document Retrieval Experiments using Indexing Vocabularies of varying Size. Ii. Hashing, truncation, digram and Trigram Encoding of Index Terms.
J. Documentation, 1979
J. Chem. Inf. Comput. Sci., 1979
Sampling Consideration in the Selection of Fragment Screens for Chemical Substructure Search Systems.
J. Chem. Inf. Comput. Sci., 1979
A Qualitative Comparison of Wiswesser Line Notation Descriptors of Reactions and the Derwent Chemical Reaction Documentation Service.
J. Chem. Inf. Comput. Sci., 1979
1978
The Production of Machine-Readable Descriptions of Chemical Reactions Using Wiswesser Line Notations.
J. Chem. Inf. Comput. Sci., 1978
J. Chem. Inf. Comput. Sci., 1978