Cheminformatics research at the Unilever Centre for molecular science informatics Cambridge
File(s)
Published version
Author(s)
Fuchs, Julian E
Bender, Andreas
Glen, Robert C
Type
Journal Article
Abstract
The Centre for Molecular Informatics, formerly Unilever Centre for Molecular Science Informatics (UCMSI), at the University of Cambridge is a world‐leading driving force in the field of cheminformatics. Since its opening in 2000 more than 300 scientific articles have fundamentally changed the field of molecular informatics. The Centre has been a key player in promoting open chemical data and semantic access. Though mainly focussing on basic research, close collaborations with industrial partners ensured real world feedback and access to high quality molecular data. A variety of tools and standard protocols have been developed and are ubiquitous in the daily practice of cheminformatics. Here, we present a retrospective of cheminformatics research performed at the UCMSI, thereby highlighting historical and recent trends in the field as well as indicating future directions.
Date Issued
2015-09-01
Date Acceptance
2014-12-16
Citation
Molecular Informatics, 2015, 34 (9), pp.626-633
ISSN
1611-020X
Publisher
Wiley-VCH Verlag
Start Page
626
End Page
633
Journal / Book Title
Molecular Informatics
Volume
34
Issue
9
Copyright Statement
© 2015 The Authors. Published by Wiley‐VCH Verlag GmbH & Co. KGaA. This is an open access article under the terms of the Creative Commons Attribution License, which permits use, distribution and reproduction in any medium, provided the original work is properly cited.
Identifier
http://gateway.webofknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcApp=PARTNER_APP&SrcAuth=LinksAMR&KeyUT=WOS:000364651100006&DestLinkType=FullRecord&DestApp=ALL_WOS&UsrCustomerID=1ba7043ffcc86c417c072aa74d649202
Subjects
Science & Technology
Life Sciences & Biomedicine
Technology
Chemistry, Medicinal
Computer Science, Interdisciplinary Applications
Mathematical & Computational Biology
Pharmacology & Pharmacy
Computer Science
Centre for Molecular Science Informatics
Retrospective analysis
History
Trends
Directions
MODE-OF-ACTION
SILICO TARGET PREDICTIONS
PROTEIN DESCRIPTOR SETS
CARCINOMA IN-VITRO
SELECTIVE-INHIBITION
METABOLISM
DYNAMICS
BENCHMARKING
DIVERSITY
BINDING
Publication Status
Published
Date Publish Online
2015-03-10