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ZENODO
Dataset . 2025
License: CC BY
Data sources: ZENODO
image/svg+xml art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos Open Access logo, converted into svg, designed by PLoS. This version with transparent background. http://commons.wikimedia.org/wiki/File:Open_Access_logo_PLoS_white.svg art designer at PLoS, modified by Wikipedia users Nina, Beao, JakobVoss, and AnonMoos http://www.plos.org/
ZENODO
Dataset . 2026
License: CC BY
Data sources: ZENODO
ZENODO
Dataset . 2025
License: CC BY
Data sources: Datacite
ZENODO
Dataset . 2026
License: CC BY
Data sources: Datacite
ZENODO
Dataset . 2026
License: CC BY
Data sources: Datacite
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Claim

AI-guided competitive docking for virtual screening and compound efficacy prediction

Research datakeyboard_double_arrow_right Dataset 02 Dec 2025Publisher:Zenodo
Authors: Wintjens, René;

doi: 10.5281/zenodo.17795311 , 10.5281/zenodo.17795310 , 10.5281/zenodo.18173176

AI-guided competitive docking for virtual screening and compound efficacy prediction

Abstract

Author : Manon Mirgaux, Valeria Barcelli, Adeline C.Y. Chua, Pablo Bifani, René Wintjens This dataset includes the complex models produced by diffusion-based tools (AlphaFold3, Boltz-1, and Boltz-2), together with all analysis scripts, intermediate data, and results used across the protein benchmark set. The data is licensed under the respective terms-of-use and data usage agreements (when applicable). Please consult the terms before downloading or otherwise using the data.

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
0
Average
Average
Average