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Alvarsson, Jonathan
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1

CPSign: conformal prediction for cheminformatics modeling:

Arvidsson McShane, Staffan ; Norinder, Ulf ; Alvarsson, Jonathan...
Journal of Cheminformatics.  16 (2024)  1 - p. , 2024
Link: https://doi.org/10.1186/..
 
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2

In Silico Prediction of Human Clinical Pharmacokinetics wit..:

Fagerholm, Urban ; Hellberg, Sven ; Alvarsson, Jonathan.
Alternatives to Laboratory Animals.  51 (2022)  1 - p. 39-54 , 2022
Link: https://doi.org/10.1177/..
 
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3

In Silico Predictions of the Gastrointestinal Uptake of Mac..:

Fagerholm, Urban ; Hellberg, Sven ; Alvarsson, Jonathan.
Journal of Pharmaceutical Sciences.  111 (2022)  9 - p. 2614-2619 , 2022
Link: https://doi.org/10.1016/..
 
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4

Predicting With Confidence: Using Conformal Prediction in D..:

Alvarsson, Jonathan ; Arvidsson McShane, Staffan ; Norinder, Ulf.
Journal of Pharmaceutical Sciences.  110 (2021)  1 - p. 42-49 , 2021
Link: https://doi.org/10.1016/..
 
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5

Predicting target profiles with confidence as a service usi..:

Ahmed, Laeeq ; Alogheli, Hiba ; McShane, Staffan Arvidsson...
Journal of Cheminformatics.  12 (2020)  1 - p. , 2020
Link: https://doi.org/10.1186/..
 
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6

SciPipe: A workflow library for agile development of comple..:

Lampa, Samuel ; Dahlö, Martin ; Alvarsson, Jonathan.
GigaScience.  8 (2019)  5 - p. , 2019
Link: https://doi.org/10.1093/..
 
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7

SciPipe—Turning Scientific Workflows into Computer Programs:

Lampa, Samuel ; Dahlo, Martin ; Alvarsson, Jonathan.
Computing in Science & Engineering.  21 (2019)  3 - p. 109-113 , 2019
Link: https://doi.org/10.1109/..
 
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8

Predicting Off-Target Binding Profiles With Confidence Usin..:

Lampa, Samuel ; Alvarsson, Jonathan ; Arvidsson Mc Shane, Staffan...
Frontiers in Pharmacology.  9 (2018)  - p. , 2018
Link: https://doi.org/10.3389/..
 
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9

Evaluating parameters for ligand-based modeling with random..:

Kensert, Alexander ; Alvarsson, Jonathan ; Norinder, Ulf.
Journal of Cheminformatics.  10 (2018)  1 - p. , 2018
Link: https://doi.org/10.1186/..
 
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10

A confidence predictor for logD using conformal regression ..:

Lapins, Maris ; Arvidsson, Staffan ; Lampa, Samuel...
Journal of Cheminformatics.  10 (2018)  1 - p. , 2018
Link: https://doi.org/10.1186/..
 
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11

The Chemistry Development Kit (CDK) v2.0: atom typing, depi..:

Willighagen, Egon L. ; Mayfield, John W. ; Alvarsson, Jonathan...
Journal of Cheminformatics.  9 (2017)  1 - p. , 2017
Link: https://doi.org/10.1186/..
 
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12

Erratum to: The Chemistry Development Kit (CDK) v2.0: atom ..:

Willighagen, Egon L. ; Mayfield, John W. ; Alvarsson, Jonathan...
Journal of Cheminformatics.  9 (2017)  1 - p. , 2017
Link: https://doi.org/10.1186/..
 
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13

Towards agile large-scale predictive modelling in drug disc..:

Lampa, Samuel ; Alvarsson, Jonathan ; Spjuth, Ola
Journal of Cheminformatics.  8 (2016)  1 - p. , 2016
Link: https://doi.org/10.1186/..
 
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14

Ex Vivo Assessment of Drug Activity in Patient Tumor Cells ..:

Blom, Kristin ; Nygren, Peter ; Alvarsson, Jonathan..
SLAS Technology.  21 (2016)  1 - p. 178-187 , 2016
Link: https://doi.org/10.1177/..
 
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15

Large-scale ligand-based predictive modelling using support..:

Alvarsson, Jonathan ; Lampa, Samuel ; Schaal, Wesley...
Journal of Cheminformatics.  8 (2016)  1 - p. , 2016
Link: https://doi.org/10.1186/..
 
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