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Efficient iterative virtual screening with Apache Spark and conformal prediction
Ahmed, Laeeq
Georgiev, Valentin
Uppsala University, Disciplinary Domain of Medicine and Pharmacy, Faculty of Pharmacy, Department of Pharmaceutical Biosciences.
(Spjuth)
ORCID iD:
0000-0002-6064-2684
Capuccini, Marco
Uppsala University, Disciplinary Domain of Medicine and Pharmacy, Faculty of Pharmacy, Department of Pharmaceutical Biosciences. Uppsala University, Disciplinary Domain of Science and Technology, Mathematics and Computer Science, Department of Information Technology, Computational Science.
(Spjuth)
ORCID iD:
0000-0002-4851-759X
Toor, Salman
Uppsala University, Disciplinary Domain of Science and Technology, Mathematics and Computer Science, Department of Information Technology, Computational Science.
Schaal, Wesley
Uppsala University, Disciplinary Domain of Medicine and Pharmacy, Faculty of Pharmacy, Department of Pharmaceutical Biosciences.
(Spjuth)
ORCID iD:
0000-0001-6770-0878
Laure, Erwin
Spjuth, Ola
Uppsala University, Disciplinary Domain of Medicine and Pharmacy, Faculty of Pharmacy, Department of Pharmaceutical Biosciences.
(Spjuth)
ORCID iD:
0000-0002-8083-2864
Show others and affiliations
2018 (English)
In:
Journal of Cheminformatics, ISSN 1758-2946, E-ISSN 1758-2946, Vol. 10, article id 8
Article in journal (Refereed) Published
Place, publisher, year, edition, pages
2018. Vol. 10, article id 8
National Category
Bioinformatics (Computational Biology)
Identifiers
URN:
urn:nbn:se:uu:diva-343980
DOI:
10.1186/s13321-018-0265-z
ISI:
000426699400001
PubMedID:
29492726
OAI: oai:DiVA.org:uu-343980
DiVA, id:
diva2:1187365
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eSSENCE
Available from:
2018-03-01
Created:
2018-03-03
Last updated:
2019-06-24
Bibliographically approved
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Georgiev, Valentin
Capuccini, Marco
Toor, Salman
Schaal, Wesley
Spjuth, Ola
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Capuccini, Marco
Toor, Salman
Schaal, Wesley
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