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Accurate Hit Estimation for Iterative Screening Using Venn-ABERS Predictors

  • Ruben Buendia
  • , Thierry Kogej
  • , Ola Engkvist
  • , Lars Carlsson
  • , Henrik Linusson
  • , Ulf Johansson
  • , Paolo Toccaceli
  • , Ernst Ahlberg

Research output: Contribution to journalArticlepeer-review

Original languageEnglish
Article number3
Pages (from-to)1230-1237
Number of pages8
JournalJournal of Chemical Information and Modeling
Volume59
Early online date6 Feb 2019
DOIs
Publication statusPublished - 25 Mar 2019

Keywords

  • HTS, High Throughput Screening, Drug Discovery, Probabilistic Prediction

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