المؤلفون: Emma L. Schymanski, Christoph Ruttkies, Martin Krauss, Céline Brouard, Tobias Kind, Kai Dührkop, Felicity Allen, Arpana Vaniya, Dries Verdegem, Sebastian Böcker, Juho Rousu, Huibin Shen, Hiroshi Tsugawa, Tanvir Sajed, Oliver Fiehn, Bart Ghesquière, Steffen Neumann

المصدر: Journal of Cheminformatics, Vol 9, Iss 1, Pp 1-21 (2017)

مصطلحات موضوعية: Compound identification, In silico fragmentation, High resolution mass spectrometry, Metabolomics, Structure elucidation, Information technology, T58.5-58.64, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: http://link.springer.com/article/10.1186/s13321-017-0207-1; https://doaj.org/toc/1758-2946

URL الوصول: https://doaj.org/article/013056657b734f69b3d71c7aa087fc60

المؤلفون: Huibin Shen, Nicola Zamboni, Markus Heinonen, Juho Rousu

المصدر: Metabolites, Vol 3, Iss 2, Pp 484-505 (2013)

مصطلحات موضوعية: metabolite identification, molecular fingerprints, machine learning, FingerID, Microbiology, QR1-502

وصف الملف: electronic resource

Relation: http://www.mdpi.com/2218-1989/3/2/484; https://doaj.org/toc/2218-1989

URL الوصول: https://doaj.org/article/8fbc238ce7c143b4b0d4b5ae6c6cd6a1

المؤلفون: Huibin Shen, Nicola Zamboni, Markus Heinonen, Juho Rousu

المساهمون: The Pennsylvania State University CiteSeerX Archives

المصدر: http://www.mdpi.com/2218-1989/3/2/484/pdf/.

مصطلحات موضوعية: metabolite identification, molecular fingerprints, machine learning, FingerI

Relation: http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.637.4759; http://www.mdpi.com/2218-1989/3/2/484/pdf/

الاتاحة: http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.637.4759
http://www.mdpi.com/2218-1989/3/2/484/pdf/

المؤلفون: Iaroslav Shcherbatyi, Valerio Perrone, Amr Ahmed, Jean Baptiste Faddoul, Tanya Bansal, Cédric Archambeau, Huibin Shen, Krishnaram Kenthapadi, Fela Winkelmolen, Rodolphe Jenatton, Matthias Seeger, Michele Donini, Aida Zolic, Miroslav Miladinovic, Barbara Pogorzelska

المصدر: KDD

مصطلحات موضوعية: FOS: Computer and information sciences, Hyperparameter, Computer Science - Machine Learning, Early stopping, Computer science, business.industry, Computer Science - Artificial Intelligence, Bayesian optimization, Machine Learning (stat.ML), Machine learning, computer.software_genre, Machine Learning (cs.LG), Set (abstract data type), Random search, Artificial Intelligence (cs.AI), Statistics - Machine Learning, Metric (mathematics), Scalability, Systems architecture, Artificial intelligence, business, computer

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::62cd76b18a6c10c8cd3fd099d277cd65
http://arxiv.org/abs/2012.08489

المؤلفون: Nikita Ivkin, Miroslav Miladinovic, Zohar Karnin, Andre Perunicic, Kumar Venkateswar, Aida Zolic, Iaroslav Shcherbatyi, Patricia Grao, Huibin Shen, Tanya Bansal, Leo Parker Dirac, Piali Das, Laurence Rouesnel, Alex Tang, Lakshmi Ramakrishnan, Philip Gautier, Bhaskar Dutt, Wilton Wu, Cedric Archembeau, Amr Ahmed, Fela Winkelmolen

المصدر: DEEM@SIGMOD

مصطلحات موضوعية: Computer science, Distributed computing, media_common.quotation_subject, Scale (chemistry), 020207 software engineering, 02 engineering and technology, 010501 environmental sciences, 01 natural sciences, Column (database), Pipeline (software), law.invention, Set (abstract data type), law, Scalability, Autopilot, 0202 electrical engineering, electronic engineering, information engineering, Quality (business), White box, 0105 earth and related environmental sciences, media_common

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::3cb001c62f1c6e8fcaeb6971035ff567
https://doi.org/10.1145/3399579.3399870

المؤلفون: Marvin Meusel, Sebastian Böcker, Juho Rousu, Kai Dührkop, Huibin Shen

المصدر: PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA. 112(41):12580-12585

مصطلحات موضوعية: ta113, ta112, Multidisciplinary, Tandem, Database, ta213, Chemistry, Mass spectrometry, computer.software_genre, Tandem mass spectrum, Small molecule, Metabolomics, Fragmentation (mass spectrometry), ta5141, Molecule, ta518, computer, PubChem, ta515

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6a5fc0aeadbc42f0b3f7478c4b7638a1
http://juuli.fi/Record/0336805415

المؤلفون: Huibin Shen

الاتاحة: https://dx.doi.org/10.13140/rg.2.2.12799.00161
http://rgdoi.net/10.13140/RG.2.2.12799.00161

المؤلفون: Sebastian Böcker, Huibin Shen, Juho Rousu, Kai Dührkop

المصدر: Bioinformatics

مصطلحات موضوعية: Statistics and Probability, Computer science, Metabolite, computer.software_genre, Biochemistry, chemistry.chemical_compound, Metabolomics, Fragmentation (mass spectrometry), Artificial Intelligence, Tandem Mass Spectrometry, Molecular Biology, Multiple kernel learning, Molecular Structure, food and beverages, Original Papers, Computer Science Applications, Computational Mathematics, Computational Theory and Mathematics, chemistry, Mass Spectrometry and Proteomics, Mass spectrum, Ismb 2014 Proceedings Papers Committee, Data mining, computer, Algorithms, Software

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::188f213143009dbdef091f74936fc863
http://juuli.fi/Record/0338105914

المؤلفون: Juho Rousu, Huibin Shen, Nicola Zamboni, Markus Heinonen

المساهمون: Aalto-yliopisto, Aalto University

المصدر: Metabolites, Vol 3, Iss 2, Pp 484-505 (2013)
Metabolites
Metabolites; Volume 3; Issue 2; Pages: 484-505

مصطلحات موضوعية: Identification methods, Web server, Computer science, Endocrinology, Diabetes and Metabolism, lcsh:QR1-502, computer.software_genre, Machine learning, 01 natural sciences, Biochemistry, Bottleneck, Article, lcsh:Microbiology, Set (abstract data type), 03 medical and health sciences, metabolite identification, molecular fingerprints, machine learning, FingerID, Molecular Biology, 030304 developmental biology, 0303 health sciences, business.industry, 010401 analytical chemistry, Rank (computer programming), 0104 chemical sciences, Identification (information), Filter (video), Data mining, Artificial intelligence, business, computer, PubChem

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::00a6a271ccaa161319749fa404bdac43
http://www.mdpi.com/2218-1989/3/2/484

المؤلفون: Schymanski, Emma, Ruttkies, Christoph, Krauss, Martin, CĂŠline Brouard, Kind, Tobias, DĂźhrkop, Kai, Allen, Felicity, Arpana Vaniya, Verdegem, Dries, BĂścker, Sebastian, Rousu, Juho, Huibin Shen, Tsugawa, Hiroshi, Sajed, Tanvir, Fiehn, Oliver, GhesquièRe, Bart, Neumann, Steffen

مصطلحات موضوعية: Data_FILES, ComputingMethodologies_DOCUMENTANDTEXTPROCESSING

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::6647e6cedaa35c97eec14fb6cd018dfb

المؤلفون: Sandor Szedmak, Céline Brouard, Huibin Shen, Juho Rousu

المساهمون: Aalto University

المصدر: Lecture Notes in Computer Science
19th International Conference on Discovery Science
19th International Conference on Discovery Science, Oct 2016, Bari, Italy. ⟨10.1007/978-3-319-46307-0_27⟩
Discovery Science ISBN: 9783319463063
DS

مصطلحات موضوعية: 0301 basic medicine, Graph kernel, Multiple kernel learning, Computer science, business.industry, [SDV]Life Sciences [q-bio], Soft margin SVM, Pattern recognition, 02 engineering and technology, One-class SVM, Upper and lower bounds, Support vector machine, 03 medical and health sciences, 030104 developmental biology, Kernel method, Polynomial kernel, Radial basis function kernel, 0202 electrical engineering, electronic engineering, information engineering, 020201 artificial intelligence & image processing, Artificial intelligence, Tree kernel, business, Kernel target alignment

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5a7e542ef9a6cdec7d6bc51e8e067e79
https://hal.inrae.fr/hal-02741192

المؤلفون: Kai Dührkop, Huibin Shen, Florence d'Alché-Buc, Juho Rousu, Céline Brouard, Sebastian Böcker

المساهمون: Department of Computer Science, Friedrich Schiller University Jena, Telecom ParisTech, Aalto-yliopisto, Aalto University, Helsinki Institute for Information Technology (HIIT), Aalto University-University of Helsinki, Friedrich-Schiller-Universität = Friedrich Schiller University Jena [Jena, Germany], Laboratoire Traitement et Communication de l'Information (LTCI), Télécom ParisTech-Institut Mines-Télécom [Paris] (IMT)-Centre National de la Recherche Scientifique (CNRS), Academy of Finland [Grant 268874/MIDAS]

المصدر: Bioinformatics
Bioinformatics, Oxford University Press (OUP), 2016, 32 (12), pp.i28-i36. ⟨10.1093/bioinformatics/btw246⟩
Bioinformatics 12 (32), i28-i36. (2016)

مصطلحات موضوعية: 0301 basic medicine, Statistics and Probability, Matching (graph theory), [SDV]Life Sciences [q-bio], Feature vector, Space (mathematics), Machine learning, computer.software_genre, 01 natural sciences, Biochemistry, Machine Learning, 03 medical and health sciences, Tandem Mass Spectrometry, Metabolomics, Molecular Biology, Ismb 2016 Proceedings July 8 to July 12, 2016, Orlando, Florida, Mathematics, ta113, Input/output, Molecular Structure, business.industry, 010401 analytical chemistry, Computational Biology, Applied Bioinformatics, 0104 chemical sciences, Computer Science Applications, Parameter identification problem, Computational Mathematics, Identification (information), 030104 developmental biology, Computational Theory and Mathematics, Kernel (statistics), Kernel regression, Artificial intelligence, business, Algorithm, computer, Algorithms, Databases, Chemical

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::04377ada265b1c8b3e4f3e76860f0d1f
https://pubmed.ncbi.nlm.nih.gov/27307628

المؤلفون: Juho Rousu, Markus Heinonen, Huibin Shen, Nicola Zamboni

المصدر: Bioinformatics, 28 (18)

مصطلحات موضوعية: Statistics and Probability, Computer science, Metabolite, Mass spectrometry, Tandem mass spectrometry, computer.software_genre, Machine learning, 01 natural sciences, Biochemistry, Tandem mass spectrum, 03 medical and health sciences, chemistry.chemical_compound, Metabolomics, Artificial Intelligence, Tandem Mass Spectrometry, ta518, Molecular Biology, ta515, 030304 developmental biology, ta113, ta112, 0303 health sciences, ta213, business.industry, 010401 analytical chemistry, 3. Good health, 0104 chemical sciences, Computer Science Applications, Computational Mathematics, Computational Theory and Mathematics, chemistry, ta5141, Artificial intelligence, Data mining, business, computer, Databases, Chemical, PubChem

وصف الملف: application/application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b6539c26496a35447ec29504a2d50261
https://hdl.handle.net/20.500.11850/55584

المؤلفون: Huibin, Shen, Nicola, Zamboni, Markus, Heinonen, Juho Rousu, H Shen, N Zamboni, M Heinonen, amp, Rousu, Huibin Shen, Nicola Zamboni, Markus Heinonen

المساهمون: The Pennsylvania State University CiteSeerX Archives

المصدر: https://research.aalto.fi/files/12713305/metabolites_03_00484.pdf.

وصف الملف: application/pdf

Relation: http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.1079.9765

الاتاحة: http://citeseerx.ist.psu.edu/viewdoc/summary?doi=10.1.1.1079.9765

المؤلفون: Dührkop, Kai¹, Huibin Shen², Meusel, Marvin¹, Rousu, Juho², Böcker, Sebastian¹ sebastian.boecker@uni-jena.de

المصدر: Proceedings of the National Academy of Sciences of the United States of America. 10/13/2015, Vol. 112 Issue 41, p12580-12585. 6p.

مصطلحات موضوعية: *METABOLITES, *METABOLOMICS, *TANDEM mass spectrometry, *MOLECULAR structure, *MACHINE learning