Author Archive

Autumn 2026 ChemSpider webinars

ChemSpider hosts regular free, data-themed webinars. These evolve around how data is enabling and embedded in chemical research, educating the community about existing models and tools, as well as addressing challenges and discussing solutions for better chemistry data management. Our sessions encourage chemists across all sectors and career stages to embrace better digital data practices.

Webinar 4: AI & tools in chemistry – register for free

Tuesday 22 September 2026, 3 pm (BST)

Speakers

  • Ewa Gajewska, Head of Product Management, Merck KGaA, Germany
  • Alan Kenwright, SimpleNMR, UK

Click here to find out more about this webinar.


Webinar 5: Empowering data management – register for free

Tuesday 20 October 2026, 3 pm (BST)

Speakers

  • Samantha Kanza, Senior Enterprise Fellow, University of Southampton, UK
  • Monique Roerdink Lander, JMP
  • Wendy Tseng, JMP

Click here to find out more about this webinar.


Webinar 6: Data reuse – register for free

Tuesday 17 November 2026, 3 pm (GMT)

Speakers

  • Kathryn Cowtan, Professor of Chemistry, University of York, UK

Click here to find out more about this webinar.

 


Sponsored by

Collaborative Drug Design logo

Collaborative Drug Discovery (CDD) provides a secure, intuitive, web-based software suite that helps research scientists organize and analyse their data. Biologists and chemists use CDD Vault to register entities, manage inventory, record experiments, and evaluate structure–activity relationships. CDD Vault also standardizes and structures data, making it easier to leverage the latest advances in AI and machine learning capabilities. CDD recently released the CDD Vault Connector for Claude Desktop, unlocking new possibilities for AI-powered workflows. Founded in 2004, CDD supports thousands of researchers worldwide across academic, biotechnology, and pharmaceutical organizations. Learn more at www.collaborativedrug.com

 

JMP logoSAS created JMP in 1989 to empower scientists and engineers to explore data visually. Since then, JMP has grown from a single product into a family of statistical discovery tools, each one tailored to meet specific needs. All of our software is visual, interactive, comprehensive and extensible.
JMP is the data analysis tool of choice for hundreds of thousands of scientists, engineers and other data explorers worldwide. Users leverage powerful statistical and analytic capabilities in JMP to discover the unexpected.

 

Merck company logo Merck KGaA Darmstadt Germany is a leading science and technology company with a broad portfolio across life science, healthcare, and electronics. Through SYNTHIA® Retrosynthesis Software, Merck helps chemists accelerate route design, explore novel synthetic pathways, and make more informed decisions in chemical research. Expert-coded by chemists and engineered by computer scientists, SYNTHIA® supports faster, smarter, and more efficient synthesis planning for both new and published target molecules


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Webinar 6: Data reuse

In this free webinar, our panellists will discuss their experiences of reusing data. We will explore the importance of data quality and AI-ready data, as well as touch on the benefits of reusing data and how to properly acknowledge and give credit to the data generators.

Register for free

Tuesday 17 November 2026, 3 pm (GMT)

Speakers

Kathryn Cowtan, Professor of Chemistry, University of York, UK

Headshot of Kathryn CowtanKathryn is an interdisciplinary data scientist working at York Structural Biology Laboratory. She developed software for key steps in the solution of molecular structures from X-ray crystallography data and cryo-electron microscopy. In the last decade Kathryn has also become interested in data analysis problems in climate science. In addition to working with the UK Met Office and other organizations on historical observations and climate model outputs, she has also worked with psychologists and social scientists on understanding and responding to the motivated rejection of climate science. Recently Kathryn has developed a postgraduate taught programme in data science with major emphasis on reducing barriers to participation, especially in the areas of gender and neurodiversity.

 


Sponsored by

Collaborative Drug Design logo

Collaborative Drug Discovery (CDD) provides a secure, intuitive, web-based software suite that helps research scientists organize and analyse their data. Biologists and chemists use CDD Vault to register entities, manage inventory, record experiments, and evaluate structure–activity relationships. CDD Vault also standardizes and structures data, making it easier to leverage the latest advances in AI and machine learning capabilities. CDD recently released the CDD Vault Connector for Claude Desktop, unlocking new possibilities for AI-powered workflows. Founded in 2004, CDD supports thousands of researchers worldwide across academic, biotechnology, and pharmaceutical organizations. Learn more at www.collaborativedrug.com

 

JMP logoSAS created JMP in 1989 to empower scientists and engineers to explore data visually. Since then, JMP has grown from a single product into a family of statistical discovery tools, each one tailored to meet specific needs. All of our software is visual, interactive, comprehensive and extensible.
JMP is the data analysis tool of choice for hundreds of thousands of scientists, engineers and other data explorers worldwide. Users leverage powerful statistical and analytic capabilities in JMP to discover the unexpected.

 

Merck company logo Merck KGaA Darmstadt Germany is a leading science and technology company with a broad portfolio across life science, healthcare, and electronics. Through SYNTHIA® Retrosynthesis Software, Merck helps chemists accelerate route design, explore novel synthetic pathways, and make more informed decisions in chemical research. Expert-coded by chemists and engineered by computer scientists, SYNTHIA® supports faster, smarter, and more efficient synthesis planning for both new and published target molecules


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Webinar 5: Empowering data management

In this free webinar, our speakers will share advice on how to manage your data and where to seek help. We will discuss the importance of good data management, touch relevant standards and community projects that enable and support researchers.  

Register for free

Tuesday 20 October 2026, 3 pm (BST)

Speakers

Samantha Pearman-Kanza, Principal Enterprise Fellow, University of Southampton, UK

 

Monique Roerdink Lander, JMP

 

Wendy Tseng, JMP

 


Sponsored by

Collaborative Drug Design logo

Collaborative Drug Discovery (CDD) provides a secure, intuitive, web-based software suite that helps research scientists organize and analyse their data. Biologists and chemists use CDD Vault to register entities, manage inventory, record experiments, and evaluate structure–activity relationships. CDD Vault also standardizes and structures data, making it easier to leverage the latest advances in AI and machine learning capabilities. CDD recently released the CDD Vault Connector for Claude Desktop, unlocking new possibilities for AI-powered workflows. Founded in 2004, CDD supports thousands of researchers worldwide across academic, biotechnology, and pharmaceutical organizations. Learn more at www.collaborativedrug.com

 

JMP logoSAS created JMP in 1989 to empower scientists and engineers to explore data visually. Since then, JMP has grown from a single product into a family of statistical discovery tools, each one tailored to meet specific needs. All of our software is visual, interactive, comprehensive and extensible.
JMP is the data analysis tool of choice for hundreds of thousands of scientists, engineers and other data explorers worldwide. Users leverage powerful statistical and analytic capabilities in JMP to discover the unexpected.

 

Merck company logo Merck KGaA Darmstadt Germany is a leading science and technology company with a broad portfolio across life science, healthcare, and electronics. Through SYNTHIA® Retrosynthesis Software, Merck helps chemists accelerate route design, explore novel synthetic pathways, and make more informed decisions in chemical research. Expert-coded by chemists and engineered by computer scientists, SYNTHIA® supports faster, smarter, and more efficient synthesis planning for both new and published target molecules


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Webinar 4: AI & tools in chemistry

In this free webinar, our panellists will showcase how AI and tools are enabling chemical research. We will explore how data drives these innovations and the impact they can have on day-to-day research activities.  

Register for free

Tuesday 22 September 2026, 3 pm (BST)

Speakers

Ewa Gajewska, Head of Product Management, Merck KGaA, Germany

headshot Ewa GajewskaDr. Ewa Gajewska is the Head of Product Management at Merck KGaA, Darmstadt, Germany, where she leads the development of SYNTHIA® Retrosynthesis Software – a groundbreaking software for computer-assisted synthetic planning. She graduated in biotechnology and chemistry from the Gdansk University of Technology and was a recipient of the Outstanding Achievements Award from Poland’s Minister of Science and Higher Education. In 2020 she received her PhD from the Institute of Organic Chemistry at the Polish Academy of Sciences. Her passion for tackling complex scientific challenges within commercial settings and the unique blend of her interdisciplinary skills drive the realization of innovative features of SYNTHIA® Retrosynthesis Software.

Alan Kenwright, SimpleNMR, UK

 


Sponsored by

Collaborative Drug Design logo

Collaborative Drug Discovery (CDD) provides a secure, intuitive, web-based software suite that helps research scientists organize and analyse their data. Biologists and chemists use CDD Vault to register entities, manage inventory, record experiments, and evaluate structure–activity relationships. CDD Vault also standardizes and structures data, making it easier to leverage the latest advances in AI and machine learning capabilities. CDD recently released the CDD Vault Connector for Claude Desktop, unlocking new possibilities for AI-powered workflows. Founded in 2004, CDD supports thousands of researchers worldwide across academic, biotechnology, and pharmaceutical organizations. Learn more at www.collaborativedrug.com

 

JMP logoSAS created JMP in 1989 to empower scientists and engineers to explore data visually. Since then, JMP has grown from a single product into a family of statistical discovery tools, each one tailored to meet specific needs. All of our software is visual, interactive, comprehensive and extensible.
JMP is the data analysis tool of choice for hundreds of thousands of scientists, engineers and other data explorers worldwide. Users leverage powerful statistical and analytic capabilities in JMP to discover the unexpected.

 

Merck company logo Merck KGaA Darmstadt Germany is a leading science and technology company with a broad portfolio across life science, healthcare, and electronics. Through SYNTHIA® Retrosynthesis Software, Merck helps chemists accelerate route design, explore novel synthetic pathways, and make more informed decisions in chemical research. Expert-coded by chemists and engineered by computer scientists, SYNTHIA® supports faster, smarter, and more efficient synthesis planning for both new and published target molecules


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Spring 2026 ChemSpider webinars

Our webinars will showcase current and planned initiatives to develop standards and tools, research infrastructures, and developing cultures to support FAIR chemistry data preparation, publication, and reuse, and explore what’s needed to evolve a better future using chemistry data. Our speakers represent the wider chemistry community, with representatives from academia, industry, as well as national and international initiatives.

Webinar 1: Where to begin with AI and ML? – watch the recording

Tuesday April 14th 2026, 3 pm (BST)

Speakers

  • Nessa Carson, Digital Champion, AstraZeneca, UK – SLIDES
  • Raquel López-Ríos de Castro, Postdoctoral Fellow, Freie Universität Berlin, Germany – SLIDES

Webinar Q&A

Click here to find out more about this webinar.


Webinar 2: Data storage and management – watch the recording

Tuesday May 19th 2026, 3 pm (BST)

Speakers

  • Nongnuch Artrith, Assistant Professor, Utrecht University, Netherlands – SLIDES
  • Nicole Jung, Project Leader, Karlsruhe Institute of Technology, Germany – SLIDES
  • Benjamin Deadman, Program Manager, Open Reaction Database, UK – SLIDES

Click here to find out more about this webinar.


Webinar 3: Chemical standards and representation – watch the recording

Tuesday June 23rd 2026, 3 pm (BST)

Speakers

  • J. Christian Baber, Chief Portfolio Officer, The Pistoia Alliance, UK – SLIDES
  • Jonathan M Goodman, Professor of Chemistry, University of Cambridge, UK – SLIDES

Webinar Q&A

Click here to find out more about this webinar.


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Webinar 3: Chemical standards & representation

In this free webinar, our panellists will discuss the importance of data standards in chemistry. They will share thoughts on community-endorsed  and commercial standards, and explore their limitations.

 

This webinar took place on Tuesday June 23rd, 3 pm BST.

Watch the recording!

Webinar Q&A

 

Speakers

J. Christian Baber, Chief Portfolio Officer, The Pistoia Alliance, UK

headshot of speaker Christian BaberChristian Baber is a chemist by training and holds undergraduate and PhD degrees in computational chemistry with a focus on AI techniques to assess the synthetic accessibility of de novo design compounds. Christian continued this work with a post-doctoral fellowship on the automated design of targeted combinatorial libraries at the Department of Knowledge Engineering, Osaka University, Japan before moving into industry initially as a computational chemist and cheminformatician. Christian has a wide breadth of R&D experience across companies ranging from startups to large pharma with a focus on informatics and predictive modeling for drug discovery but has also managed development systems and lab & automation teams including compound management and high-throughput purification. As Chief Portfolio Officer of the Pistoia Alliance, he is responsible for all of the projects, communities and training run under the umbrella of the Alliance from the initial idea, through execution, to delivery of artifacts and sustainability of products.

Talk title: Chemical standards and representation – SLIDES

 

Jonathan M Goodman, Professor of Chemistry, University of Cambridge, UK

Headshot of speaker Jonathan GoodmanJonathan Goodman studied boron-mediated aldol reactions during his PhD with Professor Ian Paterson FRS at the University of Cambridge. He then did postdoctoral research with Professor Clark Still at Columbia University, before returning to Cambridge, where he is now Professor of Chemistry and a Fellow of Clare College. He currently chairs the CSA Trust, is a trustee of the CCDC, is a committee member of the RSC’s chemical information and computer applications group (CICAG) and attends the InChI Trust Board ex officio. His current research focusses on analysing reaction mechanisms, interpreting analytical data, and developing methods in chemical informatics. 

Talk title: InChI, wInChI spider – SLIDES

 


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Webinar 2: Data storage and management

In this free webinar, our panellists will share their thoughts on data storage, discussing repositories and databases, as well as everyday data management using tools such as electronic lab notebooks (ELNs).

 

This webinar took place on Tuesday May 19th, 3 pm BST.

Watch the recording!

 

Speakers

Nicole Jung, Project Leader, Karlsruhe Institute of Technology, Germany

Headshot of Nicole JungNicole Jung is a chemist by training and works in the group of Stefan Bräse at the Karlsruhe Institute of Technology (KIT) on topics dealing with the digital transformation of chemical research through advanced data infrastructures and tools. She is an active contributor to research data management (RDM) and data-driven innovation in chemistry, combining domain expertise in organic chemistry with a strong focus on data standardization, accessibility, and reuse. Nicole is deeply engaged in national and international data initiatives. As part of the Helmholtz Program Information she is engaged in different Helmholtz metadata collaboration (HMC) projects and as one of the co-spokespersons of the National Research Data Infrastructure for Chemistry (NFDI4Chem) she contributes to the development of an electronic lab notebook for chemists, the establishment of a repository for research data, and software for research data management in chemistry in general. Since 2023, she is project leader of the Platform for Automated Chemical Synthesis and Analysis (ChemASAP), one of the first self-driving labs established at KIT.

Talk title: RDM with Chemotion – Chemotion repository – SLIDES

 

Benjamin Deadman, Reaction Data Evangelist and Program Manager, Open Reaction Database, UK

Headshot of Benjamin Deadman

Ben is an independent Consultant Scientist specialising in digital chemistry, and one of his major activities is supporting the Open Reaction Database and its user community. Previously Ben was the founding Facility Manager of the Centre for Rapid Online Analysis of Reactions (ROAR), a shared state-of-the-art facility providing the UK chemical R&D community with the tools and protocols needed to perform data-rich experimentation in chemistry. Ben received an MSc from the University of Waikato (New Zealand) before moving to the University of Cambridge (UK) as a Commonwealth Scholar in 2009. After completing his PhD under the supervision of Prof. Steven Ley in 2013, he had postdoctoral research positions at University College Cork (Ireland) with Prof. Anita Maguire and the Solid State Pharmaceutical Centre (SSPC), and then at Imperial College London (UK) with Prof. Mimi Hii and Prof. Klaus Hellgardt.

Talk title: Management of Reaction Data with the Open Reaction DatabaseSLIDES

 

Nongnuch Artrith, Assistant Professor, Utrecht University, Netherlands

headshot of speaker Nong ArtrithDr. Nongnuch Artrith (https://github.com/atomisticnet) holds the position of Assistant Professor in the Materials Chemistry and Catalysis group at the Debye Institute for Nanomaterials Science, Utrecht University. She is also a PI in the Columbia Center for Computational Electrochemistry. Nong is the main developer of the open-source Atomic Energy Network (ænet) (http://ann.atomistic.net), a package for the construction and application of machine learning models for materials science. Her research interests focus on the development and application of first principles and ML methods for the computational discovery of energy materials and for the interpretation of experimental observations.

Talk title: Database for harnessing machine learning to advance energy materials – SLIDES

 


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Webinar 1: Where to begin with AI and ML?

In this free webinar, our panellists will share their thoughts on how to get started with artificial intelligence (AI) and machine learning (ML), covering aspects such as developing AI/ML, reusing data and selecting the right data sources, as well as the ethics involved with this.

 

This webinar took place on Tuesday April 14th, 3 pm BST.

Watch the recording!

Webinar Q&A

 

Speakers

Nessa Carson, Digital Champion, AstraZeneca, UK

Headshot of Nessa CarsonNessa Carson received Master’s degrees in synthesis and catalysis from Oxford University and the University of Illinois at Urbana-Champaign. She started out as a synthetic chemist for AMRI, then moved within the company to run the high-throughput automation facility for Eli Lilly in Windlesham, working across discovery and process chemistry, then in high-throughput reaction optimization at Pfizer and then Syngenta. Nessa moved to AstraZeneca in 2022 as Digital Champion, focussing on digital transformation and making life easier for scientists, and currently works in the Predictive Science, Digital, and Automation team. She was awarded the Salters’ Institute Centenary Award for early-career chemists with the potential to make an outstanding long-term contribution to industrial chemistry. 

Talk title: Data foundations: Developing AI agents for laboratory science in pharma – SLIDES

 

Raquel López-Ríos de Castro, Postdoctoral FellowFreie Universität Berlin, Germany 

Raquel López-Ríos de Castro headshot Raquel López-Ríos de Castro is a Marie Skłodowska-Curie Postdoctoral Fellow working between Freie Universität Berlin (with Prof. Cecilia Clementi) and Memorial Sloan Kettering Cancer Center (with Prof. John Chodera). She was previously a postdoctoral researcher in the Volkamer lab, with which she continues to collaborate. Her research sits at the intersection of machine learning and molecular simulation, with a focus on accelerating drug discovery. She develops ML models to enhance protein structure predictions in drug discovery by incorporating key physical details, bridging the gap between AI-driven structure prediction and physics-based simulations. Raquel completed her PhD at King’s College London, where she developed computational platforms for drug delivery and peptide therapeutics using multiscale molecular dynamics and data-driven methods. Her work has been recognized with the Institute of Physics Jocelyn Bell Burnell Medal and an invitation to the Physics Lindau Nobel Laureate Meeting as a young scientist. 

Talk title: Where to begin with AI and ML? (for chemistry) – SLIDES


About ChemSpider

Explore more than 138 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Register for our 2025 ChemSpider webinars

Our webinars will showcase current and planned initiatives to develop standards and tools, research infrastructures, and developing cultures to support FAIR chemistry data preparation, publication, and reuse, and explore what’s needed to evolve a better future using chemistry data. Our speakers represent the wider chemistry community, with representatives from academia, industry, as well as national and international initiatives.

Webinar 1: AI in chemistry – Watch the recording

Tuesday September 23rd 2025, 3 pm (BST)

Speakers

  • Jacob Al-Saleem, Data Science Manager, CAS, USA – SLIDES
  • Bea (Birgit) Braun, Research Fellow, Dow Chemical Company, USA – SLIDES
  • Garrison Cottrell, Professor for Computer Science and Engineering, University of California San Diego, USA – SLIDES

Click here to find out more about this webinar.


Webinar 2: Data standards in chemistry – Watch the recording

Tuesday October 21st 2025, 3 pm (BST)

Speakers

  • Kamil Dziubek, University Assistant, University of Vienna, AustriaSLIDES
  • Robert Hanson, Professor of Chemistry, Emeritus, St. Olaf College, USASLIDES
  • Wendy Patterson, Scientific Director, Beilstein-Institut, Germany – SLIDES

Webinar Q&A

Click here to find out more about this webinar.


Webinar 3: Data management – Watch the recording

Tuesday November 18th 2025, 3 pm (GMT)

Speakers

  • Jonathan Hirst, Professor of Computational Chemistry, University of Nottingham, UK  – SLIDES
  • Oliver Koepler, Head of Lab Linked Scientific Knowledge, TIB – Leibniz Information Centre for Science and Technology, GermanySLIDES
  • Nicolas Triballeau, Director Drug Discovery Chemistry, Revvity Signals, France – SLIDES

Click here to find out more about this webinar.

 


Sponsored by

Logo for revvity signalsRevvity Signals Software delivers AI-enhanced solutions to accelerate R&D workflows and enable data-driven innovation. Trusted by pharma and biotech, our portfolio includes ChemDraw®, Signals Notebook, Signals One, Signals Synergy, Signals Clinical, and Spotfire®, empowering scientists with predictive analytics, seamless collaboration, and interactive visualizations for groundbreaking discoveries.

 

Supported by

Logo of NFDI4ChemLogo of the Beilstein Institut Digital Discovery logo  International Union of Crystallography logo


About ChemSpider

Explore more than 128 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider

Webinar 3: Data management

In this webinar, our panellist will share their thoughts about data management, which tools to use, what standards to follow and how to get everyone involved. We will touch on the value of good data management, as well as benefits of data reuse.

Watch the recording

 

Speakers

Oliver Koepler, Head of Lab Linked Scientific Knowledge, TIB – Leibniz Information Centre for Science and Technology, Germany

Headshot of Oliver KoeplerDr. Oliver Koepler is head of the Lab Linked Scientific Knowledge at TIB – Leibniz Information Centre for Science and Technology, where he leads research and developments at the intersection of chemistry, data science, and knowledge engineering. Since 2005, he has been instrumental in transforming chemical research through digital innovation, developing e-infrastructures and research data management services that support scientists throughout the entire data lifecycle. He is a spokesperson of NFDI4Chem which has developed innovative tools like the SmartLab environment with Chemotion electronic lab notebook, the federation of Data repositories, the Terminology and Search Service that promote FAIR data principles across the chemistry community.

Talk title: Unlocking Chemical Research Data – The NFDI4Chem Service & Infrastructure Federation – SLIDES

 

Jonathan Hirst, Professor of Computational Chemistry, University of Nottingham, UK  

Headshot of Jonathan HirstJonathan Hirst is Professor in Computational Chemistry at the University of Nottingham. In 2020, he was awarded a Chair in Emerging Technologies by the Royal Academy of Engineering, focusing on research that will empower the development of next-generation molecules that chemical engineers and chemists make, by using machine learning to augment human decision-making. His tenure as Head of School (2013-2017) saw some significant transformations under his leadership, including the building of the GSK Carbon Neutral Laboratory and a successful bid for an Athena Swan Silver Award. 

Talk title: AI4Green: Empowering scientists to make sustainable choicesSLIDES

 

Nicolas Triballeau, Director Drug Discovery Chemistry, Revvity Signals, France

Nicholas Triballeau headshotNicolas Triballeau is Director – Drug Discovery Chemistry at Revvity Signals. With 17 years of experience in drug discovery, he has not only provided direct project support and led teams but has also played a significant role in establishing scientific standards and ontologies. Nicolas holds a master’s degree in chemical engineering with a specialization in organic chemistry, a Pharm.D. and a Ph.D. in Drug Design from the University of Paris. 

Talk Title: Importance of Good Data Management – SLIDES

 


Sponsored by

Logo for revvity signalsRevvity Signals Software delivers AI-enhanced solutions to accelerate R&D workflows and enable data-driven innovation. Trusted by pharma and biotech, our portfolio includes ChemDraw®, Signals Notebook, Signals One, Signals Synergy, Signals Clinical, and Spotfire®, empowering scientists with predictive analytics, seamless collaboration, and interactive visualizations for groundbreaking discoveries.

 

Supported by

Logo of NFDI4ChemLogo of the Beilstein Institut Digital Discovery logo  International Union of Crystallography logo


About ChemSpider

Explore more than 128 million structures on the ChemSpider database. Including over 200 data sources, ChemSpider is a valuable source of information for chemical scientists working with data.

Freely accessible and comprehensive, this rich source of structure-based chemistry information is a fundamental resource for chemical scientists working with data everywhere.

Explore ChemSpider