Lars Carlsson

Lars Carlsson

Royal Holloway University of London - Egham / United Kingdom
Natural Sciences / Mathematical Sciences
AD Scientific Index ID: 4359440
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person_outline Lars Carlsson's MOST POPULAR ARTICLES
1-) The Chemistry Development Kit (CDK) v2. 0: atom typing, depiction, molecular formulas, and substructure searchingEL Willighagen, JW Mayfield, J Alvarsson, A Berg, L Carlsson, ...Journal of cheminformatics 9 (1), 1-19, 20173072017
2-) Circular fingerprints: flexible molecular descriptors with applications from physical chemistry to ADMERC Glen, A Bender, CH Arnby, L Carlsson, S Boyer, J SmithIDrugs 9 (3), 199, 20062292006
3-) ExCAPE-DB: an integrated large scale dataset facilitating Big Data analysis in chemogenomicsJ Sun, N Jeliazkova, V Chupakhin, JF Golib-Dzib, O Engkvist, L Carlsson, ...Journal of cheminformatics 9, 1-9, 20171852017
4-) Introducing conformal prediction in predictive modeling. A transparent and flexible alternative to applicability domain determinationU Norinder, L Carlsson, S Boyer, M EklundJournal of chemical information and modeling 54 (6), 1596-1603, 20142102014
5-) State-of-the-art tools for computational site of metabolism predictions: comparative analysis, mechanistical insights, and future applicationsL Afzelius, C Hasselgren Arnby, A Broo, L Carlsson, C Isaksson, U Jurva, ...Drug metabolism reviews 39 (1), 61-86, 20071552007