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: 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/dataset/ChemBioSim_Enhancing_Conformal_Prediction_of_In_Vivo_Toxicity_by_Use_of_Predicted_Bioactivities/14818525

الاتاحة: https://doi.org/10.1021/acs.jcim.1c00451.s003

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/dataset/ChemBioSim_Enhancing_Conformal_Prediction_of_In_Vivo_Toxicity_by_Use_of_Predicted_Bioactivities/14818522

الاتاحة: https://doi.org/10.1021/acs.jcim.1c00451.s002