Mike Lynch Award 2025: Val Gillet

In recognition of her pioneering research in chemical structure analysis, visionary educational leadership, and enduring dedication to advancing scientific collaboration, Professor Val Gillet has been awarded the 2025 Mike Lynch Award by the Trustees of the CSA Trust.

The Trustees are proud to honor Professor Gillet for her outstanding and innovative contributions to the field of Chemoinformatics. Her influential body of work – widely cited and highly regarded – has shaped the Chemoinformatics landscape and driven progress in pharmaceutical research and development.

In parallel with her research achievements, Professor Gillet has played a central role in building and refining the Chemoinformatics educational program at the University of Sheffield. Under her supervision, the program has earned international recognition as a hub of excellence for research and training. She is also co-author of a foundational textbook that remains a key reference in the field.

Beyond her academic accomplishments, Professor Gillet has been instrumental in fostering collaboration and visibility within Chemoinformatics. Her longstanding support of the Cheminformatics Conference in Sheffield and the International Conference on Chemical Structures in Noordwijkerhout has helped elevate them to the field’s most prominent international gatherings.

Val Gillet is a Professor of Chemoinformatics at the University of Sheffield, where she leads the Chemoinformatics Research Group within School of Information, Journalism and Communication.

https://www.linkedin.com/in/val-gillet-15a60429/

https://www.sheffield.ac.uk/ijc/people/val-gillet

The CSA Trust is an internationally recognized, registered charity that promotes education, research, and development in fields related to chemical structures and cheminformatics.

Professor Michael Felix Lynch

February 21, 1932 – November 15, 2024

One of the pioneers of chemical information, Michael (Mike) Felix Lynch, has died at the age of 92. Mike obtained B.Sc. and Ph.D. degrees in chemistry at University College, Dublin before conducting postdoctoral research at ETH Zürich with Vladimir Prelog, the recipient of the 1975 Nobel Prize for chemistry. He then worked for two years with Ciba-Geigy in Cambridge U.K., before moving to the United States in 1961 to work for Chemical Abstracts Service (CAS). At this time, CAS was conducting some of the first research anywhere on the use of computers to build searchable databases of both journal abstracts and of the structures of chemical compounds, and Mike directed much of this work when he became Head of the Basic Research Department.1,2

On returning to the United Kingdom in 1965, he was awarded a research grant by the Office of Scientific and Technical Information to conduct studies of the automatic indexing of textual documents. He joined the University of Sheffield’s Postgraduate School of Librarianship (as it was then named, now the Information School) to conduct this research, and spent the rest of his career there until his retirement in 1997. Mike can truly be regarded as the founding father of information science research at Sheffield: starting as a Senior Research Fellow, he joined the permanent staff in 1968, and in 1974 he was appointed to the personal chair which made him the first professor of information science in the United Kingdom.

Mike’s initial research in Sheffield involved the development of methods for the automated production of articulated subject indexes such as those used in the CAS subject indexes.3 This work was followed by initial studies of techniques for the indexing, storage, and retrieval of chemical reaction information. These studies, which focused on the identification of the reaction center involved in a transformation, continued for over a decade before the development of graph-matching techniques that, after extensive subsequent refinement, underlie modern reaction retrieval systems.4,5 While this work was under way he started to develop and test systematic approaches for the selection of fragment substructures6 for screening chemical substructure searches, and was also responsible for probably the first book anywhere on the computer handling of chemical structures.7 In addition to their use in chemical information systems, the selection techniques developed for screening subsequently found application in several types of textual processing, for example, for compression, for sorting, and for searching online catalogs.8

Much of the second half of Mike’s Sheffield career, from 1980 onwards, was devoted to the development of techniques for the representation, storage, and retrieval of the generic (Markush) structures that characterize many chemical patents. This work extended over some 15 years and was carried out in collaboration with CAS, Derwent, and International Documentation for Chemistry (IDC).9,10 Other areas of interest in this period included the use of parallel computer architectures for database searching11 and the application of natural language processing methods to the textual components of chemical patents.12

When Mike arrived in Sheffield in the mid-1960s, there was very little computer-related research being undertaken in library schools in the United Kingdom. His work established a tradition that has enabled the Sheffield school to play a leading role over the years in the development not just of chemical information but also of information science more generally, with several of the researchers that he supervised subsequently following academic careers in Sheffield.

During his career he received many awards, perhaps most notably the 1989 Herman Skolnik Award of the ACS Division of Chemical Information for his “pioneering research of more than two decades on the development of methods for the storage, manipulation, and retrieval of chemical structures and reactions as well as related bibliographic information”. A further mark of recognition was the 2002 creation by the Chemical Structure Association Trust of an award in his name to recognize and encourage “outstanding accomplishments in education, research, and development activities that are related to the systems and methods used to store, process, and retrieve information about chemical structures, reactions, and properties”.

Mike had a huge impact not just on our own careers, but upon the whole profession, yet he will be remembered not only for his outstanding professional achievements, but also for his remarkable personal qualities. He was a practicing Roman Catholic and a devoted family man. He loved classical chamber music. He was kind and gently spoken. To journal editors who needed papers reviewing, Mike was known as a real “softie”: he looked for the value in everyone’s work and was never excessively critical. These qualities are well illustrated by the comments of one of his doctoral students, John Barnard: “Mike was generous in the independence he gave his students, without in any way stinting in the support he offered. When he was invited to talk about the Sheffield Generic Chemical Structures project at a conference, just six months after its inception, he immediately suggested that my fellow student on the project, Steve Welford, and I should do the talking instead. That immediately projected Steve and me into the center of the international chemical information community and provided us with contacts that directly benefited our subsequent careers. Mike involved us in all aspects of the development of the project, including discussions with potential funders, recruitment of additional staff, and as shareholders in its commercial exploitation. Mike’s easygoing and gentle Irish character made him an ideal companion on social occasions, whether in the bar at conferences, for pub lunches, or at the informal dinners at his home so often given for scientists visiting our project. I literally owe my entire career in chemical information systems to Mike, and it was a privilege and a pleasure to have been one of his students”.

Michael’s first wife, Mary, died of a heart condition in 1993. In 1995, he married Mary Dykstra, a professor at Dalhousie University in Halifax, Nova Scotia, Canada who had studied in Michael’s department at the University of Sheffield. They had a long and happy retirement, traveling extensively and living in both Sheffield and Nova Scotia. Mary survives him. Our sympathies also go to Catherine and Kevin, his children by his first wife; his stepsons, Mark and Jeffery Dykstra; his eight grandchildren; and other members of his extended family worldwide.

References

  1. Dyson, G. M.; Lynch, M. F. Chemical-biological activities: a computer-produced express digest. J. Chem. Doc. 1963, 3, 81-85. https://doi.org/10.1021/c160009a011
  2. Cossum, W. E.; Krakiwsky, M. L.; Lynch, M. F. Advances in automatic chemical substructure searching techniques. J. Chem. Doc. 1965, 5 (1), 33-35. https://doi.org/10.1021/c160016a006
  3. Armitage, J. E.; Lynch, M. F. Articulation in the generation of subject indexes by computer. J. Chem. Doc. 1967, 7 (3), 170-178. https://doi.org/10.1021/c160026a010
  4. Armitage, J. E.; Lynch, M. F. Automatic detection of structural similarities among chemical compounds. J. Chem. Soc. C 1967, 521-528. https://doi.org/10.1039/j39670000521
  5. Lynch, M. F.; Willett, P. The automatic detection of chemical reaction sites. J. Chem. Inf. Comput. Sci. 1978, 18 (3), 154-159. https://doi.org/10.1021/ci60015a009
  6. Adamson, G. W.; Cowell, J.; Lynch, M. F.; McLure, A. H. W.; Town, W. G.; Yapp, A. M. Strategic considerations in the design of a screening system for substructure of chemical structure files. J. Chem. Doc. 1973, 13 (3), 153-157. https://doi.org/10.1021/c160050a013
  7. Lynch, M.; Harrison, J. M.; Town, W. G.; Ash, J. Computer Handling of Chemical Structure Information, Macdonald, London and American Elsevier, New York, 1971. http://openlibrary.org/books/OL4770313M/Computer_handling_of_chemical_structure_information
  8. Lynch, M. F. Variety generation—a reinterpretation of Shannon’s mathematical theory of communication, and its implications for information science. J. Am. Soc. Inf. Sci. 1977, 28 (1), 19-25. https://doi.org/10.1002/asi.4630280104
  9. Lynch, M. F.; Barnard, J. M.; Welford, S. M. Computer storage and retrieval of generic chemical structures in patents. 1. Introduction and general strategy. J. Chem. Inf. Comput. Sci. 1981, 21 (3), 148-150. https://doi.org/10.1021/ci00031a009
  10. Lynch, M. F.; Holliday, J. D. The Sheffield generic structures project-a retrospective review. J. Chem. Inf. Comput. Sci. 1996, 36 (5), 930-936. https://doi.org/10.1021/ci950173l
  11. Brint, A. T.; Gillet, V. J.; Lynch, M. F.; Willett, P.; Manson, G. A.; Wilson, G. A. Chemical graph matching using transputer networks. Parallel Comput. 1988, 8 (1), 295-300. https://doi.org/10.1016/0167-8191(88)90133-0
  12. Lawson, M.; Kemp, N.; Lynch, M. F.; Chowdhury, G. G. Automatic extraction of citations from the text of English-language patents – an example of template mining. J. Inf. Sci. 1996, 22 (6), 423-436. https://doi.org/10.1177/016555159602200604

Wendy Warr and Peter Willett

January 18, 2025

See also:

CSA Trust 2025 Mike Lynch Award – Call for Nominations

The Chemical Structure Association Trust is calling for nominations for the 2025 Mike Lynch Award. The deadline is September 30, 2024.

The CSA Trust is an internationally recognized, registered charity that promotes education, research, and development in fields related to chemical structures and cheminformatics.

The Mike Lynch Award recognizes and encourages outstanding accomplishments in education, research, and development activities that are related to the systems and methods used to store, process, and retrieve information about chemical structures, reactions, and properties. The awardee will receive an honorarium and memento and will be invited to make a presentation at the 13th International Conference on Chemical Structures (ICCS) that is scheduled to take place June 1-5, 2025 in Noordwijkerhout, Netherlands.

To nominate an individual, please submit (a) a summary of the nominee’s accomplishments and the specific relevant work that is to be recognized (maximum one page);  (b) a brief biographical sketch, including a statement of academic qualifications and contact information; and (c) at least one seconding letter that supports the nomination and provides additional factual information with regard to the scientific achievements of the nominee. If appropriate, a list of the nominee’s publications and/or patents may also be submitted. The Award will not be given in any year in which the nominees do not meet the award criteria. Work that has not previously been recognized by other awards will usually be given particular consideration.

Please email these documents to the Secretary of the CSA Trust at chescot@aol.com by September 30, 2024.

Nominations will be reviewed by the CSA Trustees, and the awardee will be announced prior to the 13th International Conference on Chemical Structures (ICCS).

Mike Lynch is the Professor Emeritus in the Information School of the University of Sheffield, England, and is an acknowledged cheminformatics pioneer. The Mike Lynch Award was instituted in 2002, and the previous winners listed below received their awards and made presentations at the triennial International Conference on Chemical Structures in Noordwijkerhout:

2022: Greg Landrum: in recognition of his work on the development of RDKit and his fostering of the community around it, a transformative software resource for cheminformatics and machine learning.

2018:  Rudy Potenzone: 40+ year career as a provider of in-house informatics services and a creator and implementer of innovative informatics software solutions including SciFinder.

2014“InChI Team,” Steve Heller, Alan McNaught, Igor Pletnev, Steve Stein, Dmitrii Tchekhovskoi: conception and development of the IUPAC International Chemical Identifier InChI.

2011Engelbert Zass: lifetime career devoted to education in chemical information with an emphasis on database searching and the role of the intermediary.

2008Alexander (Sandy) Lawson: major contributions to chemical information handling and structure representation, particularly in the development of the Beilstein database and software.

2005:  Johann Gasteiger: outstanding accomplishments in the fields of computational chemistry and structure elucidation.

2002Peter Willett: pioneering work in maintaining and nurturing an academic centre of excellence in cheminformatics teaching and research with an emphasis on computational techniques for the processing of chemical and biological information.

13th International Conference on Chemical Structures: Call for Papers

The 13th International Conference on Chemical Structures (ICCS) will be held from 1st – 5th of June 2025 at the beautiful Conference Center in Noordwijkerhout, The Netherlands.

It will continue a well-established conference series that begun in 1973 as a workshop on Computer Representation and Manipulation of Chemical Information sponsored by the NATO Advanced Study Institute and thereafter was held under its new name every third year starting in 1987.

The 2025 conference will build on the experience of the past successful editions to offer a strong scientific program which covers all aspects of cheminformatics and molecular modeling, including for example structure-activity relationships, virtual screening, modeling metabolite networks, etc.

Participants discuss research as well as relevant technological and algorithm developments in handling and visualization of chemical structure data, workflows for complex cheminformatic analysis and machine learning. The conference fosters cooperation among organizations and researchers involved in the increasingly interwoven fields of cheminformatics and bioinformatics and combines in-depth technical presentations with ample opportunities for one-on-one discussions with the presenters.

The ICCS is seeking presentations of novel research and emerging technologies for the following Plenary Sessions.

  • Advanced Cheminformatics Techniques
  • Molecular Similarity and Diversity Analysis
  • Chemical Literature and Patent Mining
  • Spectroscopy and Structure Elucidation
  • (Automated) Reaction Handling and Optimization

Papers may be based on method and algorithm development as well as applications and case studies. Highest standards of scientific quality and validation of results will be required.

Scientific Topics

Advanced Cheminformatics Techniques
     o Molecular Similarity and Diversity Analysis
     o Chemical Literature and Patent Mining
     o Spectroscopy and Structure Elucidation
     o (Automated) Reaction Handling and Optimization

 Artificial Intelligence, Machine Learning, and QSAR
     o Consensus, Federated Learning, and Uncertainty Quantification
     o Advances in Large Language Models for Chemistry
     o Synthetic Accessibility and Retrosynthesis Planning
     o Multi-objective and Many-objective Optimization in Drug Design

 Integrative Structure-Based Drug Design
     o Molecular Dynamics and Free Energy Calculations
     o Structure-based and Rational Drug Design Innovations
     o Modeling Complex Protein Interactions
     o Computer-Assisted Protein Design and Engineering

 New Modalities and Large Chemical Data Sets
     o Design, Profiling, and Comparison of Compound Collections
     o Advances in DNA Encoded Libraries
     o Covalent inhibitors and PROTACS
     o Biologics and oligonucleotides

 Open Science, Omics, and Natural Products
     o Open Access Publishing and Collaborative Platforms
     o Findable, Accessible, Interoperable, and Reusable (FAIR)
     o Advances in X-omics
     o Natural Product Drug Discovery

They also welcome contributions in other aspects of the computer handling of chemical structure information, such as:
       o automatic structure elucidation
       o combinatorial chemistry and diversity analysis,
        o electronic publishing
        o MM or QM/MM simulations
        o modeling of ADME properties
        o material sciences
        o analysis and prediction of structures,
        o grid and cloud computing in cheminformatics

From the submissions, the program committee and the scientific advisory board will select around 30 papers for the plenary sessions. All submissions that cannot be included in the plenary sessions will be automatically considered for the poster sessions.

Mike Lynch Award

The CSA Trust Mike Lynch Award is given on a triennial basis to recognize and encourage outstanding accomplishments in education, research and development activities that are related to the systems and methods used to store, process and retrieve information about chemical structures, reactions and properties. Traditionally the award is presented on the opening night of the ICCS. CSA Trust 2025 Mike Lynch Award – Call for Nominations. Deadline is 31 August 2024. | Previous Recipients

The ICCS Conference is jointly supported by:

  • Division of Chemical Information of the American Chemical Society (ACS)
  • Chemical Structure Association Trust (CSA Trust)
  • Division of Chemical Information and Computer Science of the Chemical Society of Japan (CSJ)
  • Computers in Chemistry Division of the German Chemical Society (GDCh)
  • Royal Netherlands Chemical Society (KNCV)
  • Chemical Information and Computer Applications Group of the Royal Society of Chemistry (RSC)
  • Swiss Chemical Society (SCS)

Important Dates

  • 1 July 2024 – First call for papers
  • 1 October 2024 – Second call for papers
  • 6 January 2025 – Final call for papers
  • 14 February 2025 – Abstract submission deadline
  • 27 April 2025 – End of early registration
  • 25 May 2025 – Registration closes
  • 1-5 June 2025 – 13th ICCS

Social media



Mike Lynch Award 2022: Greg Landrum

Friday, May 13th, 2 pm CET, 1 pm BST

Greg Landrum

The Trustees of the CSA Trust are pleased to announce that Greg Landrum has been awarded the 2022 Mike Lynch Award, in recognition of his work on the development of RDKit and his fostering of the community around it, a transformative software resource for cheminformatics and machine learning.

Jonathan Goodman, chair of the CSA Trust, comments: “I am delighted that Greg Landrum has accepted this award. His work on RDKit has made chemical informatics techniques more accessible to scientists worldwide both in industry and academia. When introducing students to cheminformatics, becoming familiar with RDKit is a key part of the learning process, and makes it possible to explore new ideas in chemical information rapidly and reliably.”

Greg Landrum said: “I am really honored to have been selected for this award; it’s especially meaningful to me because of the foundational importance of Mike Lynch and the “Sheffield school” to our field. I would particularly like to thank the Trust for recognizing the importance of the RDKit community.”

Greg Landrum will be presented with the award at the 12th International Conference on Chemical Structures, where he will give a keynote address.

Notes:

Greg Landrum is a senior scientist in Sereina Riniker’s group at the ETH Zurich, Founder and Managing Director of T5 Informatics GmbH, a Senior Advisor to Knime, and the primary developer for the RDKit.

https://twitter.com/dr_greg_landrum

https://www.linkedin.com/in/greg-landrum-2764221/

https://www.rdkit.org

The CSA Trust is an internationally recognized, registered charity that promotes education, research, and development in fields related to chemical structures and cheminformatics.

The Mike Lynch Award recognizes and encourages outstanding accomplishments in education, research, and development activities that are related to the systems and methods used to store, process, and retrieve information about chemical structures, reactions, and properties.

Mike Lynch is the Professor Emeritus in the Information School of the University of Sheffield, England, and is an acknowledged cheminformatics pioneer. https://www.sheffield.ac.uk/is/people/emeritus-honorary-visiting/michael-lynch

The 12th International Conference on Chemical Structures takes place at Noordwijkerhout, June 12th – June 16th 2022.

Mike Lynch Award 2018: Dr. Rudy Potenzone

Rudy Potenzone

April 11, 2018: The Chemical Structure Association Trust (CSA Trust) is pleased to announce that it will present the triennial Mike Lynch Award to Dr. Rudy Potenzone. The purpose of the Award is to recognize and encourage outstanding accomplishments in education, research and development activities that are related to the systems and methods used to store, process and retrieve information about chemical structures, reactions and properties, and the award is named after Professor Mike Lynch, who was a pioneer in cheminformatics and the Honorary President of the Chemical Structure Association.

Rudy Potenzone is a seasoned veteran in molecular modeling, cheminformatics, and bioinformatics, and as well as being an expert practitioner of the art, he has led teams to deliver cutting-edge software products for researchers and scientists for over 25 years. He thus fully embodies the characteristics required of a recipient of the Mike Lynch Award.

Rudy’s career in informatics started at American Cyanamid, where he led a team to support 500 users of the Chemical Group Research Division. He moved to Polygen/Molecular Simulations (now part of BIOVIA) and managed a team that developed the QUANTA and CHARMm molecular modeling systems.

Rudy then moved to cheminformatics, chemical literature, and information retrieval, and as Director of the Research and New Product Development Department at Chemical Abstracts Service (CAS) played a key role in planning and developing the SciFinder product which opened up the world of published chemical information and literature directly to chemists via its intuitive graphical user interface. After CAS, Rudy focused on systems to manage internally generated information, and at Molecular Design Ltd. (MDL – now part of BIOVIA) he oversaw the development of the Isentris system to replace ISIS, as well as Assay Explorer for managing screening information, and DiscoveryGate for unified access to published data. From MDL, he moved to LION Biosciences as CEO of US Operations, working on the strategic plan for the company’s innovative integrated information platform.

From LION, Rudy moved on to bioinformatics, and at Ingenuity Systems (now part of Qiagen), he developed the roadmap for a comprehensive, human-curated biological pathway knowledgebase and associated tools. Rudy then moved back to internal chemical information management at CambridgeSoft (now part of PerkinElmer) where he managed teams working on electronic lab notebooks, and eventually oversaw the full cheminformatics product portfolio of PerkinElmer Informatics. From PerkinElmer, Rudy moved to Microsoft and exploited his extensive customer and product experience to direct Microsoft’s efforts as worldwide industry strategist for the pharmaceutical industry, including products such as SQL Server, FAST, Office, Azure, HPC, and CRM.

Rudy is currently VP of Marketing for the TranSMART Foundation, which is an emerging global, open source, public/private partnership community that is developing a comprehensive, informatics-based analysis and data-sharing cloud platform for clinical and translational research.

Rudy’s career and contributions have spanned the whole gamut of informatics disciplines that impact the biopharma industry; and they have also kept pace with and anticipated the evolution of informatics tools from individual, chemistry-focused, point applications to today’s open source, cloud-based, bench-to-bedside informatics platforms.

The CSA Trust is pleased to recognize and honor Rudy’s substantial contributions to cheminformatics with the Mike Lynch Award, which will be presented at the 11th International Conference on Chemical Structures (http://www.int-conf-chem-structures.org/) to be held in the Netherlands in May 2018.

About the CSA Trust
The CSA Trust (www.csa-trust.org) is an internationally-recognized, registered charity which promotes education, research and development in the field of storage, processing and retrieval of information about chemical structures, reactions and compounds.

Contact
Phil McHale, CSA Trust Awards Committee
phil.mchale@comcast.net

Mike Lynch Award 2014: InChI Team

This news article was reprinted using content and images from 2014 issues of the CSA Trust Newsletter (Issue 23, page 2, and Issue 24, page 18).

The Chemical Structures Association Trust is pleased to announce that the 2014 Michael Lynch Award is being presented to the “InChI Team” – Steve Heller, Alan McNaught, Igor Pletnev, Steve Stein and Dmitrii Tchekhovskoi – in recognition of their outstanding accomplishments in the conception and development of the IUPAC International Chemical Identifier, InChI.

Initial discussions on the need for a public domain structure representation standard involving Steve Heller and Steve Stein were held in the National Institute of Standards and Technology in 1999 and in 2000 Alan McNaught of IUPAC became involved, and it was decided that InChI would be an IUPAC initiative to meet the needs of the chemical and related communities. InChI was originally known as the IUPAC Chemical Identifier in 2001, and the objective was to establish a unique label, which would be a non-proprietary identifier for chemical substances that could be used in printed and electronic data sources thus enabling easier linking of diverse data compilations. This was achieved by developing a set of algorithms for the standard representation of chemical structures that is now readily accessible to chemists in all countries at no cost. The development and associated programming work on version 1 of InChI in 2005 was predominantly carried out by Dmitrii Tchekhovskoi, and in 2008 a shorter hash key version of InChI, known as InChIKey was developed by Igor Pletnev. Subsequent developments since then and ongoing, will be described in the plenary lecture.

Top left: Steve Heller, Top middle: Alan McNaught, Top right: Igor Pletnev, Bottom left: Steve Stein, Bottom middle: Dmitrii Tchekhovskoi, Bottom right: Steve Heller and Wendy Warr (Credit: Phil McHale).

The Award ceremonies took place during the 10th International Conference on Chemical Structures held in Nordwijkerhout, in The Netherlands, 1-5 June 2014

Mike Lynch Award 2011: Engelbert Zass

Elgelbert Zass

This news article was reprinted using content and images from 2012 issues of the CSA Trust Newsletter (Issue 19, page 1, 12-17).

Dr. Engelbert Zass is head of the Chemistry Biology Pharmacy Information Center of ETH Zurich. An organic chemist by training, he specialized in chemical information after receiving his Ph.D. in 1977, and collected more than 30 years experience in searching, operating and designing chemistry databases, as well as in support, training and education of users of chemical information. He has given numerous lectures and courses in Europe and the U.S., is author of more than 60 papers on chemical information and served on several advisory boards. From 1999 till 2004, he was partner in the BMBF Project “Vernetztes Studium – Chemie”, where he was engaged in the design of multimedia educational material for chemical information. Present activities include organization of information services and user support as well as teaching chemical information courses at ETH Zurich and the University of Berne. He has been selected to receive in 2011 the CSA Trust Mike Lynch Award for his lifetime work in education, research and development activities that facilitate the storage, processing and retrieval of chemical information.

Read “Corner of a magic triangle,” Martin Brändle’s interview of Engelbert Zass after Bert received the Mike Lynch Award (CSA Trust Newsletter, Issue 19, page 12-17).

Mike Lynch Award 2008: Alexander (Sandy) Lawson

Sandy Lawson received the Mike Lynch award at the Noordwijkerhout meeting in June, 2008.

This news article was reprinted using content and images from 2008 issues of the CSA Trust Newsletter (Issue 17, page 2, and Issue 18, page 1).

Professor Dr Alexander (Sandy) Lawson graduated from St Andrews University, Scotland, in 1966 with a first class honours degree in Chemistry. He went on to study at Imperial College, London, where he was awarded a PhD and DIC in 1970. He held a number of positions including research fellowships at the Universities of Kent and Mainz, directorships at the Beilstein Institute from 1982 to 1994, and subsequently directorships at MDL. He is currently Director of Research and Development at Elsevier Information Systems GmbH. Sandy has made major contributions to the fields of chemical information handling and chemical structure representation, in particular in the development of the Beilstein database and software (including the famous Lawson Number for indexing chemical structures).

Read Sandy’s article “Chemical Structure Databases: at the Crossroads of Description and Design” that was published in the CSA Trust Newsletter, Issue 17, page 3.

Mike Lynch Award 2005: Johann (Johnny) Gasteiger

Johann Gasteiger

This news article was reprinted using content and images from 2005 issues of the CSA Trust Newsletter (Issue 9, page 2, and Issue 10, page 1, 4). His picture shown above is from Wikipedia.

Professor Dr Johann Gasteiger will be honoured with the 2005 CSA Trust Mike Lynch Award. The CSA Trust acknowledges Professor Gasteiger’s outstanding accomplishments in the field of computational chemistry and structure elucidation. The award will be presented at the 7th International Conference on Chemical Structures in Noordwijkerhout, the Netherlands, in June 2005.

Professor Dr Gasteiger was born in 1941 in southern Germany and studied chemistry at the universities of Munich and Zurich.  In 1971, he achieved his PhD. After a postdoc stay at University of California, Berkeley in 1971/72, he returned to Munich where he became Professor in 1988. At the University of Erlangen–Nürnberg he founded the ‘Computer-Chemie-Centrum in 1994.  Professor Gasteiger is a member of the ACS, CSA Trust, MGMS, the German Chemical Society and of several editorial boards.

The keynote address on the Sunday evening was given by Johnny Gasteiger, who was presented with the 2005 CSA Trust Mike Lynch award by Guenter Grethe. The title of Johnny’s talk was ‘My Love Affair with Molecules – and Reactions’. Although the international language of chemistry is the two-dimensional structure diagram, Johnny com- pares molecules to human beings, and he treasures the fact that they are three-dimensional species which have skin, left and right hands and can change shape. The keynote address covered computational approaches to the generation of 3D molecular models, the calculation of molecular surface properties, the generation of multiple conformations and the identification of molecular chirality. The address concluded with a description of some of the computer methods for modelling chemical reactions. The full talk given by Johnny Gasteiger is at http://www2.chemie.uni-erlangen.de/presentations/. Following the keynote address, delegates were treated to a reception, courtesy of Elsevier MDL and a splendid rijsttafel sponsored by CAS.

Left to right: CSA Trustees Peter Willett, Johnny Gasteiger, Guenter Grethe and Peter Nichols enjoying a refreshing trip on the IJsselmeer in the Netherlands