A perspective on the sharing of docking data

Computational approaches are nowadays largely applied in drug discovery projects. Among these, molecular docking is the most used for hit identification against a drug target protein. However, many scientists in the field shed light on the lack of availability and reproducibility of the data obtaine...

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Bibliographic Details
Main Authors: Samia Aci-Sèche, Stéphane Bourg, Pascal Bonnet, Joseph Rebehmed, Alexandre G. de Brevern, Julien Diharce
Format: Article
Language:English
Published: Elsevier 2023-08-01
Series:Data in Brief
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2352340923004985