Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps

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Standard

Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps. / Rasmussen, Maria H.; Christensen, Diana S.; Jensen, Jan H.

I: SciPost Chemistry, Bind 2, Nr. 1, 2023.

Publikation: Bidrag til tidsskriftTidsskriftartikelForskningfagfællebedømt

Harvard

Rasmussen, MH, Christensen, DS & Jensen, JH 2023, 'Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps', SciPost Chemistry, bind 2, nr. 1. https://doi.org/10.21468/SciPostChem.2.1.002

APA

Rasmussen, M. H., Christensen, D. S., & Jensen, J. H. (2023). Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps. SciPost Chemistry, 2(1). https://doi.org/10.21468/SciPostChem.2.1.002

Vancouver

Rasmussen MH, Christensen DS, Jensen JH. Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps. SciPost Chemistry. 2023;2(1). https://doi.org/10.21468/SciPostChem.2.1.002

Author

Rasmussen, Maria H. ; Christensen, Diana S. ; Jensen, Jan H. / Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps. I: SciPost Chemistry. 2023 ; Bind 2, Nr. 1.

Bibtex

@article{ab2131b3ae25451da8785a0c3e42d6b2,
title = "Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps",
author = "Rasmussen, {Maria H.} and Christensen, {Diana S.} and Jensen, {Jan H.}",
year = "2023",
doi = "10.21468/SciPostChem.2.1.002",
language = "English",
volume = "2",
journal = "SciPost Chemistry",
issn = "2772-6762",
number = "1",

}

RIS

TY - JOUR

T1 - Do machines dream of atoms? Crippen's logP as a quantitative molecular benchmark for explainable AI heatmaps

AU - Rasmussen, Maria H.

AU - Christensen, Diana S.

AU - Jensen, Jan H.

PY - 2023

Y1 - 2023

U2 - 10.21468/SciPostChem.2.1.002

DO - 10.21468/SciPostChem.2.1.002

M3 - Journal article

VL - 2

JO - SciPost Chemistry

JF - SciPost Chemistry

SN - 2772-6762

IS - 1

ER -

ID: 383198032