Computing Gram Matrix for SMILES Strings using RDKFingerprint and Sinkhorn-Knopp Algorithm

Fuente: arXiv

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Bibliographic Details
Main Authors:	Ali, Sarwan, Mansoor, Haris, Chourasia, Prakash, Khan, Imdad Ullah, Patterson, Murray
Format:	Preprint
Published:	2024
Subjects:	Machine Learning
Online Access:	Acceder al recurso
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Internet

https://arxiv.org/abs/2412.14717