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- Currently displaying 161 - 180 of 556 publications
INTEGRATED NETWORK ANALYSIS USING PATIENT-SPECIFIC SINGLE NUCLEOTIDE POLYMORPHISM PROFILES UNCOVERS NEW PATHWAYS INVOLVED IN ULCERATIVE COLITIS PATHOGENESIS
GASTROENTEROLOGY
(2020)
158
S795
Structural Chemogenomics Profiling Protein-Ligand Interactions in Polypharmacological Space
(2020)
53
Chapter 5 Concepts and Applications of Conformal Prediction in Computational Drug Discovery
(2020)
63
(doi: 10.1039/9781788016841-00063)
Photoperiod Manipulation Affects Transcriptional Profile of Genes Related to Lipid Metabolism and Apoptosis in Zebrafish (Danio rerio) Larvae: Potential Roles of Gut Microbiota
Microbial Ecology
(2019)
79
933
(doi: 10.1007/s00248-019-01468-7)
Maturity assignment based on histology-validated macroscopic criteria: Tackling the stock decline of the Mediterranean swordfish (Xiphias gladius)
Aquatic Conservation Marine and Freshwater Ecosystems
(2019)
30
303
(doi: 10.1002/aqc.3248)
Nitrogen and chlorophyll status determination in durum wheat as influenced by fertilization and soil management: Preliminary results
Plos One
(2019)
14
e0225126
(doi: 10.1371/journal.pone.0225126)
From expression footprints to causal pathways: contextualizing large signaling networks with CARNIVAL
NPJ systems biology and applications
(2019)
5
40
(doi: 10.1038/s41540-019-0118-z)
Bioinformatic Approaches in the Understanding of Mechanism of Action (MoA)
(2019)
323
(doi: 10.1002/9783527818242.ch11)
Prediction of the allergic mechanism of haptens via a reaction-substructure-compound-target-pathway network system.
Toxicology Letters
(2019)
317
68
(doi: 10.1016/j.toxlet.2019.09.019)
LightGBM: An Effective and Scalable Algorithm for Prediction of Chemical Toxicity–Application to the Tox21 and Mutagenicity Data Sets
Journal of chemical information and modeling
(2019)
59
4150
(doi: 10.1021/acs.jcim.9b00633)
Applying synergy metrics to combination screening data: agreements, disagreements and pitfalls
Drug discovery today
(2019)
24
2286
(doi: 10.1016/j.drudis.2019.09.002)
Understanding compound-induced histopathology in rat liver using gene expression network methods
(2019)
(doi: 10.17863/CAM.58906)
Triazole‐Pyridine Dicarbonitrile Targets Phosphodiesterase 4 to Induce Cytotoxicity in Lung Carcinoma Cells
Chem Biodivers
(2019)
16
e1900234
(doi: 10.1002/cbdv.201900234)
Understanding Conditional Associations between ToxCast in Vitro Readouts and the Hepatotoxicity of Compounds Using Rule-Based Methods
Chemical Research in Toxicology
(2019)
33
137
Elucidating Compound Mechanism of Action and Predicting Cytotoxicity Using Machine Learning Approaches, Taking Prediction Confidence into Account.
Current Protocols in Chemical Biology
(2019)
11
e73
(doi: 10.1002/cpch.73)
Concepts and Applications of Conformal Prediction in Computational Drug Discovery
(2019)
KekuleScope: prediction of cancer cell line sensitivity and compound potency using convolutional neural networks trained on compound images.
Journal of Cheminformatics
(2019)
11
41
(doi: 10.1186/s13321-019-0364-5)
Reliable Prediction Errors for Deep Neural Networks Using Test-Time Dropout.
Journal of chemical information and modeling
(2019)
59
3330
(doi: 10.1021/acs.jcim.9b00297)
Community assessment to advance computational prediction of cancer drug combinations in a pharmacogenomic screen
Nat Commun
(2019)
10
2674
(doi: 10.1038/s41467-019-09799-2)
