ChemicalX: A Deep Learning Library for Drug Pair Scoring

Author:

Rozemberczki Benedek1,Hoyt Charles Tapley2,Gogleva Anna1,Grabowski Piotr1,Karis Klas2,Lamov Andrej3,Nikolov Andriy1,Nilsson Sebastian3,Ughetto Michael3,Wang Yu4,Derr Tyler4,Gyori Benjamin M.2

Affiliation:

1. AstraZeneca, Cambridge, United Kingdom

2. Harvard Medical School, Cambridge, MA, USA

3. AstraZeneca, Gothenburg, Sweden

4. Vanderbilt University, Nashville, TN, USA

Funder

DARPA

Publisher

ACM

Reference53 articles.

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2. PyKEEN 1.0: a Python Library for Training and Evaluating Knowledge Graph Embeddings;Ali Mehdi;Journal of Machine Learning Research,2021

3. Kuru Halil Brahim , Oznur Tastan , and Ercument Cicek . 2021. MatchMaker: A Deep Learning Framework for Drug Synergy Prediction . IEEE/ACM Transactions on Computational Biology and Bioinformatics ( 2021 ). Kuru Halil Brahim, Oznur Tastan, and Ercument Cicek. 2021. MatchMaker: A Deep Learning Framework for Drug Synergy Prediction. IEEE/ACM Transactions on Computational Biology and Bioinformatics (2021).

4. Xusheng Cao , Rui Fan , and Wanwen Zeng . 2020. DeepDrug: A General Graph- Based Deep Learning Framework for Drug Relation Prediction. bioRxiv ( 2020 ). Xusheng Cao, Rui Fan, and Wanwen Zeng. 2020. DeepDrug: A General Graph- Based Deep Learning Framework for Drug Relation Prediction. bioRxiv (2020).

5. Yukuo Cen Zhenyu Hou Yan Wang Qibin Chen etal 2021. CogDL: An Extensive Toolkit for Deep Learning on Graphs. (2021). Yukuo Cen Zhenyu Hou Yan Wang Qibin Chen et al. 2021. CogDL: An Extensive Toolkit for Deep Learning on Graphs. (2021).

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