UB Paderborn / Katalog / Suche / in CDI

Sortiert nach

Einfacher Volltextzugriff von (fast) überall

Installieren Sie die LibKey Nomad-Browsererweiterung und erhalten Sie von vielen Webseiten einfachen Zugriff auf lizenzierte Volltexte oder Open Access Publikationen. Mehr erfahren...

Towards reproducible computational drug discovery

Journal of cheminformatics, 2020-01, Vol.12 (1), p.9-9, Article 9

2020

Volltextzugriff (PDF)

Novel applications of Machine Learning in cheminformatics

Journal of cheminformatics, 2018-09, Vol.10 (1), p.46-2, Article 46

Spjuth, Ola

2018

Volltextzugriff (PDF)

Advances in Predictions of Oral Bioavailability of Candidate Drugs in Man with New Machine Learning Methodology

Molecules (Basel, Switzerland), 2021-04, Vol.26 (9), p.2572

2021

Volltextzugriff (PDF)

Deep Learning in Image Cytometry: A Review

Cytometry. Part A, 2019-04, Vol.95 (4), p.366-380

2019

Volltextzugriff (PDF)

WhichCyp: prediction of cytochromes P450 inhibition

Bioinformatics, 2013-08, Vol.29 (16), p.2051-2052

2013

Volltextzugriff (PDF)

The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

Journal of cheminformatics, 2017-06, Vol.9 (1), p.33-19, Article 33

2017

Volltextzugriff (PDF)

Evaluating parameters for ligand-based modeling with random forest on sparse data sets

Journal of cheminformatics, 2018-10, Vol.10 (1), p.49-10, Article 49

2018

Volltextzugriff (PDF)

Synergy conformal prediction applied to large-scale bioactivity datasets and in federated learning

Journal of cheminformatics, 2021-10, Vol.13 (1), p.77-77, Article 77

2021

Volltextzugriff (PDF)

Estimating diagnostic uncertainty in artificial intelligence assisted pathology using conformal prediction

Nature communications, 2022-12, Vol.13 (1), p.7761-7761, Article 7761

2022

Volltextzugriff (PDF)

Conformal Regression for Quantitative Structure–Activity Relationship ModelingQuantifying Prediction Uncertainty

Journal of chemical information and modeling, 2018-05, Vol.58 (5), p.1132-1140

2018

Volltextzugriff (PDF)

Integrating cell morphology with gene expression and chemical structure to aid mitochondrial toxicity detection

Communications biology, 2022-08, Vol.5 (1), p.858-15, Article 858

2022

Volltextzugriff (PDF)

Assessing the calibration in toxicological in vitro models with conformal prediction

Journal of cheminformatics, 2021-04, Vol.13 (1), p.35-14, Article 35

2021

Volltextzugriff (PDF)

A phenomics approach for antiviral drug discovery

BMC biology, 2021-08, Vol.19 (1), p.156-15, Article 156

2021

Volltextzugriff (PDF)

Federated learning for predicting compound mechanism of action based on image-data from cell painting

Artificial intelligence in the life sciences, 2024-06, Vol.5, p.100098, Article 100098

2024

Volltextzugriff (PDF)

Author Correction: A method for Boolean analysis of protein interactions at a molecular level

Nature communications, 2023-09, Vol.14 (1), p.5450-5450, Article 5450

2023

Volltextzugriff (PDF)

A method for Boolean analysis of protein interactions at a molecular level

Nature communications, 2022-08, Vol.13 (1), p.4755-4755, Article 4755

2022

Volltextzugriff (PDF)

Evaluating the utility of brightfield image data for mechanism of action prediction

PLoS computational biology, 2023-07, Vol.19 (7), p.e1011323-e1011323

2023

Volltextzugriff (PDF)

Merging bioactivity predictions from cell morphology and chemical fingerprint models using similarity to training data

Journal of cheminformatics, 2023-06, Vol.15 (1), p.56-56, Article 56

2023

Volltextzugriff (PDF)

SimVec: predicting polypharmacy side effects for new drugs

Journal of cheminformatics, 2022-07, Vol.14 (1), p.49-49, Article 49

2022

Volltextzugriff (PDF)

A confidence predictor for logD using conformal regression and a support-vector machine

Journal of cheminformatics, 2018-04, Vol.10 (1), p.17-10, Article 17

2018

Volltextzugriff (PDF)

Alterations in the tyrosine and phenylalanine pathways revealed by biochemical profiling in cerebrospinal fluid of Huntington's disease subjects

Scientific reports, 2019-03, Vol.9 (1), p.4129-4129, Article 4129

2019

Volltextzugriff (PDF)

CPSign: conformal prediction for cheminformatics modeling

Journal of cheminformatics, 2024-06, Vol.16 (1), p.75-17, Article 75

2024

Volltextzugriff (PDF)

Combining molecular and cell painting image data for mechanism of action prediction

Artificial intelligence in the life sciences, 2023-12, Vol.3, p.100060, Article 100060

2023

Volltextzugriff (PDF)

Designing microplate layouts using artificial intelligence

Artificial intelligence in the life sciences, 2023-12, Vol.3, p.100073, Article 100073

2023

Volltextzugriff (PDF)

Predicting Off-Target Binding Profiles With Confidence Using Conformal Prediction

Frontiers in pharmacology, 2018-11, Vol.9, p.1256

2018

Volltextzugriff (PDF)

1 – 25 von 156

Suche als RSS-Feed

Suchergebnisse filtern

Filter anzeigen

Nur zeigen

Geprüft (Peer-Review)
(138)
Mit Volltextzugriff
(137)

Publikationsform

Sprache

Englisch
(156)

Erscheinungsjahr

n.n

Zeitschrift / Serie

5 weitere anzeigen...

Weniger anzeigen...

Neu hinzugefügt

... seit 30 Tagen
(1)
... seit 90 Tagen
(2)

Menü

Weitere Dienste

Einstellungen

Towards reproducible computational drug discovery

Novel applications of Machine Learning in cheminformatics

Advances in Predictions of Oral Bioavailability of Candidate Drugs in Man with New Machine Learning Methodology

Deep Learning in Image Cytometry: A Review

WhichCyp: prediction of cytochromes P450 inhibition

The Chemistry Development Kit (CDK) v2.0: atom typing, depiction, molecular formulas, and substructure searching

Evaluating parameters for ligand-based modeling with random forest on sparse data sets

Synergy conformal prediction applied to large-scale bioactivity datasets and in federated learning

Estimating diagnostic uncertainty in artificial intelligence assisted pathology using conformal prediction

Conformal Regression for Quantitative Structure–Activity Relationship ModelingQuantifying Prediction Uncertainty

Integrating cell morphology with gene expression and chemical structure to aid mitochondrial toxicity detection

Assessing the calibration in toxicological in vitro models with conformal prediction

A phenomics approach for antiviral drug discovery

Federated learning for predicting compound mechanism of action based on image-data from cell painting

Author Correction: A method for Boolean analysis of protein interactions at a molecular level

A method for Boolean analysis of protein interactions at a molecular level

Evaluating the utility of brightfield image data for mechanism of action prediction

Merging bioactivity predictions from cell morphology and chemical fingerprint models using similarity to training data

SimVec: predicting polypharmacy side effects for new drugs

A confidence predictor for logD using conformal regression and a support-vector machine

Alterations in the tyrosine and phenylalanine pathways revealed by biochemical profiling in cerebrospinal fluid of Huntington's disease subjects

CPSign: conformal prediction for cheminformatics modeling

Combining molecular and cell painting image data for mechanism of action prediction

Designing microplate layouts using artificial intelligence

Predicting Off-Target Binding Profiles With Confidence Using Conformal Prediction

Suchergebnisse filtern