المؤلفون: Staffan Arvidsson McShane, Ulf Norinder, Jonathan Alvarsson, Ernst Ahlberg, Lars Carlsson, Ola Spjuth

المصدر: Journal of Cheminformatics, Vol 16, Iss 1, Pp 1-17 (2024)

مصطلحات موضوعية: Information technology, T58.5-58.64, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/1758-2946

URL الوصول: https://doaj.org/article/5bc293f6d66346fca78338f8c969d309

المؤلفون: Andrea Morger, Marina Garcia de Lomana, Ulf Norinder, Fredrik Svensson, Johannes Kirchmair, Miriam Mathea, Andrea Volkamer

المصدر: Scientific Reports, Vol 12, Iss 1, Pp 1-13 (2022)

مصطلحات موضوعية: Medicine, Science

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2045-2322

URL الوصول: https://doaj.org/article/9640412f156b4083ba647cd502b86051

المؤلفون: Erik Ylipää, Swapnil Chavan, Maria Bånkestad, Johan Broberg, Björn Glinghammar, Ulf Norinder, Ian Cotgreave

المصدر: Current Research in Toxicology, Vol 5, Iss , Pp 100121- (2023)

مصطلحات موضوعية: Deep Learning, Graph-neural Network, hERG Channel, Random Forest, Recurrent-neural Network, Support-vector Machines, Toxicology. Poisons, RA1190-1270

وصف الملف: electronic resource

Relation: http://www.sciencedirect.com/science/article/pii/S2666027X23000191; https://doaj.org/toc/2666-027X

URL الوصول: https://doaj.org/article/198c2d71252c4f7faf20e58bf0f5d471

المؤلفون: Ulf Norinder, Ola Spjuth, Fredrik Svensson

المصدر: Journal of Cheminformatics, Vol 13, Iss 1, Pp 1-11 (2021)

مصطلحات موضوعية: Conformal prediction, Federated learning, Confidence, Machine learning, Information technology, T58.5-58.64, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/1758-2946

URL الوصول: https://doaj.org/article/ee0f00aed94d46caa89b6f53dcc606e0

المؤلفون: Andrea Morger, Fredrik Svensson, Staffan Arvidsson McShane, Niharika Gauraha, Ulf Norinder, Ola Spjuth, Andrea Volkamer

المصدر: Journal of Cheminformatics, Vol 13, Iss 1, Pp 1-14 (2021)

مصطلحات موضوعية: Toxicity prediction, Conformal prediction, Data drifts, Applicability domain, Calibration plots, Tox21 datasets, Information technology, T58.5-58.64, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/1758-2946

URL الوصول: https://doaj.org/article/8fe425216aae4b26b97229dddbe63ab8

المؤلفون: Francesco Gentile, Vibudh Agrawal, Michael Hsing, Anh-Tien Ton, Fuqiang Ban, Ulf Norinder, Martin E. Gleave, Artem Cherkasov

المصدر: ACS Central Science, Vol 6, Iss 6, Pp 939-949 (2020)

مصطلحات موضوعية: Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2374-7951

URL الوصول: https://doaj.org/article/03c7527ee20e46a48e7996f887fbe9be

المؤلفون: Ulf Norinder (827452), Petra Norinder (12034581)

مصطلحات موضوعية: Science Policy, Biological Sciences not elsewhere classified, Amazon customer reviews, machine learning, conformal prediction, deep learning, natural language processing, temporal test sets

Relation: https://figshare.com/articles/journal_contribution/Predicting_Amazon_customer_reviews_with_deep_confidence_using_deep_learning_and_conformal_prediction/19108335

الاتاحة: https://doi.org/10.6084/m9.figshare.19108335.v1

المؤلفون: Ulf Norinder

المصدر: Molecules; Volume 28; Issue 1; Pages: 217

مصطلحات موضوعية: CATMoS dataset, CDDD, BERT, conformal prediction, random forest, RDKit

جغرافية الموضوع: agris

وصف الملف: application/pdf

Relation: Computational and Theoretical Chemistry; https://dx.doi.org/10.3390/molecules28010217

الاتاحة: https://doi.org/10.3390/molecules28010217

المؤلفون: Anke Wilm (Center for Bioinformatics (ZBH), Department of Informatics, Universität Hamburg), Marina Garcia de Lomana (Department of Pharmaceutical Sciences, Faculty of Life Sciences, University of Vienna), Conrad Stork (Center for Bioinformatics (ZBH), Department of Informatics, Universität Hamburg), Neann Mathai (Computational Biology Unit (CBU), Department of Chemistry, University of Bergen), Steffen Hirte (Department of Pharmaceutical Sciences, Faculty of Life Sciences, University of Vienna), Ulf Norinder (MTM Research Centre, School of Science and Technology, Örebro University), Jochen Kühnl (Front End Innovation, Beiersdorf AG), Johannes Kirchmair (Department of Pharmaceutical Sciences, Faculty of Life Sciences, University of Vienna)

المصدر: Pharmaceuticals ; issn:1424-8247

مصطلحات موضوعية: skin sensitization, toxicity prediction, in silico prediction, machine learning, random forest, conformal prediction, bioactivity descriptors

وصف الملف: application/pdf

Relation: hdl:11353/10.1545076; https://phaidra.univie.ac.at/o:1545076

الاتاحة: https://doi.org/10.3390/ph14080790
https://phaidra.univie.ac.at/o:1545076

المؤلفون: Marina Garcia de Lomana (Department of Pharmaceutical Sciences, Faculty of Life Sciences, University of Vienna), Andrea Morger (In Silico Toxicology and Structural Bioinformatics, Institute of Physiology, Charité Universitätsmedizin Berlin), Ulf Norinder (MTM Research Centre, School of Science and Technology, Örebro University), Roland Buesen (BASF SE, Ludwigshafen am Rhein), Robert Landsiedel (BASF SE, Ludwigshafen am Rhein), Andrea Volkamer (In Silico Toxicology and Structural Bioinformatics, Institute of Physiology, Charité Universitätsmedizin Berlin), Johannes Kirchmair (Department of Pharmaceutical Chemistry, Faculty of Life Sciences, University of Vienna), Miriam Mathea (BASF SE, Ludwigshafen am Rhein)

المصدر: Journal of Chemical Information and Modeling ; issn:1549-9596

مصطلحات موضوعية: Assays, Bioactivity, Mathematical methods, Molecular modeling, Toxicity

وصف الملف: application/pdf

Relation: hdl:11353/10.1536329; https://phaidra.univie.ac.at/o:1536329

الاتاحة: https://doi.org/10.1021/acs.jcim.1c00451
https://phaidra.univie.ac.at/o:1536329

المؤلفون: Ulf Norinder (11516348), Ola Spjuth (11516351), Fredrik Svensson (11516354)

مصطلحات موضوعية: Biophysics, Biochemistry, Sociology, Infectious Diseases, Plant Biology, Computational Biology, Biological Sciences not elsewhere classified, Information Systems not elsewhere classified, Conformal prediction, Federated learning, Confidence, Machine learning

Relation: https://figshare.com/articles/journal_contribution/Additional_file_1_of_Synergy_conformal_prediction_applied_to_large-scale_bioactivity_datasets_and_in_federated_learning/16726850

الاتاحة: https://doi.org/10.6084/m9.figshare.16726850.v1

المؤلفون: Marina Garcia de Lomana (5578643), Andrea Morger (10726702), Ulf Norinder (827452), Roland Buesen (9756835), Robert Landsiedel (2630344), Andrea Volkamer (1444000), Johannes Kirchmair (490109), Miriam Mathea (4331506)

مصطلحات موضوعية: Biochemistry, Molecular Biology, Pharmacology, Immunology, Space Science, Biological Sciences not elsewhere classified, Mathematical Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, vivo endpoints, Predicted Bioactivities Computation., MNT, vivo toxicity endpoints, DILI, Enhancing Conformal Prediction, conformal prediction framework, bioactivity descriptors, DICC, bioactivity assay outcomes, bioactivity CP models, vivo toxicity data sets, F 1 scores, chemical, vivo toxicity CP models, vivo toxicological endpoints, conformal prediction models

Relation: https://figshare.com/articles/journal_contribution/ChemBioSim_Enhancing_Conformal_Prediction_of_In_Vivo_Toxicity_by_Use_of_Predicted_Bioactivities/14818519

الاتاحة: https://doi.org/10.1021/acs.jcim.1c00451.s001

المؤلفون: Jin Zhang (53297), Ulf Norinder (827452), Fredrik Svensson (1292214)

مصطلحات موضوعية: Sociology, Biological Sciences not elsewhere classified, Mathematical Sciences not elsewhere classified, Information Systems not elsewhere classified, conformal prediction framework, conformal predictors, Toxicity Predictive modeling, Deep Learning-Based Conformal Predi., Tox 21 challenge, toxicity predictions

Relation: https://figshare.com/articles/journal_contribution/Deep_Learning-Based_Conformal_Prediction_of_Toxicity/14690985

الاتاحة: https://doi.org/10.1021/acs.jcim.1c00208.s001

المؤلفون: Andrea Morger (10726702), Fredrik Svensson (1292214), Staffan Arvidsson McShane (10726705), Niharika Gauraha (10726708), Ulf Norinder (827452), Ola Spjuth (91840), Andrea Volkamer (8710002)

مصطلحات موضوعية: Artificial Intelligence and Image Processing, Toxicity prediction, Conformal prediction, Data drifts, Applicability domain, Calibration plots, Tox21 datasets

Relation: https://figshare.com/articles/journal_contribution/Additional_file_1_of_Assessing_the_calibration_in_toxicological_in_vitro_models_with_conformal_prediction/14516380

الاتاحة: https://doi.org/10.6084/m9.figshare.14516380.v1

المؤلفون: Alexander Kensert, Jonathan Alvarsson, Ulf Norinder, Ola Spjuth

المصدر: Journal of Cheminformatics, Vol 10, Iss 1, Pp 1-10 (2018)

مصطلحات موضوعية: Random forest, Support vector machines, Sparse representation, Fingerprint, Machine learning, Information technology, T58.5-58.64, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: http://link.springer.com/article/10.1186/s13321-018-0304-9; https://doaj.org/toc/1758-2946

URL الوصول: https://doaj.org/article/d1e4c95911014903976a9ab48d8fbd72

المؤلفون: Fredrik Svensson, Avid M. Afzal, Ulf Norinder, Andreas Bender

المصدر: Journal of Cheminformatics, Vol 10, Iss 1, Pp 1-10 (2018)

مصطلحات موضوعية: Conformal prediction, HTS, Gain-cost function, PubChem datasets, Information technology, T58.5-58.64, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: http://link.springer.com/article/10.1186/s13321-018-0260-4; https://doaj.org/toc/1758-2946

URL الوصول: https://doaj.org/article/8e9bd8d6b0bc40d2af87a1b809d18427

المؤلفون: Anke Wilm (Center for Bioinformatics (ZBH), Department of Informatics, Universität Hamburg), Ulf Norinder (Department of Computer and Systems Sciences, Stockholm University), M. Isabel Agea (Department of Informatics and Chemistry, University of Chemistry and Technology Prague), Christina de Bruyn Kops (Center for Bioinformatics (ZBH), Department of Informatics, Universität Hamburg), Conrad Stork (Center for Bioinformatics (ZBH), Department of Informatics, Universität Hamburg), Jochen Kühnl (Front End Innovation, Beiersdorf AG), Johannes Kirchmair (Department of Pharmaceutical Chemistry, Faculty of Life Sciences, University of Vienna)

المصدر: Chemical Research in Toxicology ; issn:0893-228X

وصف الملف: application/pdf

Relation: isPartOf:https://phaidra.univie.ac.at/o:243553[u:scholar collection]; hdl:11353/10.1217908; https://phaidra.univie.ac.at/o:1217908

الاتاحة: https://doi.org/10.1021/acs.chemrestox.0c00253
https://phaidra.univie.ac.at/o:1217908

المؤلفون: Ulf Norinder, Astrud Tuck, Kalle Norgren, Vesna Munic Kos

المصدر: Biomedicine & Pharmacotherapy, Vol 130, Iss , Pp 110582- (2020)

مصطلحات موضوعية: COVID-19, Antiviral drugs, Drug repositioning, Lysosomotropism, Endosomal pathway, Broad spectrum antivirals, Therapeutics. Pharmacology, RM1-950

Relation: http://www.sciencedirect.com/science/article/pii/S0753332220307757; https://doaj.org/toc/0753-3322; https://doaj.org/article/b02ac72ed99f4e28acf6f0372bc273e9

الاتاحة: https://doi.org/10.1016/j.biopha.2020.110582
https://doaj.org/article/b02ac72ed99f4e28acf6f0372bc273e9

المؤلفون: Elena Dracheva, Ulf Norinder, Patrik Rydén, Josefin Engelhardt, Jana M. Weiss, Patrik L. Andersson

المصدر: Environmental Science & Technology. 56:8363-8372

مصطلحات موضوعية: Annan kemi, Thyroid Hormones, QSAR, environmental health, endocrine disruption, Occupational Health and Environmental Health, General Chemistry, Endocrine Disruptors, Miljövetenskap, High-Throughput Screening Assays, Xenobiotics, conformal prediction, Arbetsmedicin och miljömedicin, Humans, Environmental Chemistry, Computer Simulation, Other Chemistry Topics, Environmental Sciences

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ba250b2e94dae22292695d68517ea00c
https://doi.org/10.1021/acs.est.1c07762

المؤلفون: Andreas Luttens, Israel Cabeza de Vaca, Leonard Sparring, Ulf Norinder, Jens Carlsson

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::526e701bb5bb941cbd26676724795db8
https://doi.org/10.26434/chemrxiv-2023-w3x36