Exploring Graph Traversal Algorithms in Graph-Based Molecular Generation
Author:
Affiliation:
1. Molecular AI, Discovery Sciences, R&D, AstraZeneca Gothenburg Pepparedsleden 1, 431 50 Mölndal, Sweden
2. Department of Computer Science and Engineering, Chalmers University of Technology Chalmersplatsen 4, 412 96 Gothenburg, Sweden
Funder
AstraZeneca
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.1c00777
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