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Scoreformer: A Surrogate Model For Large-Scale Prediction of Docking Scores
13 June 2024
Álvaro Ciudad
Adrián Morales-Pastor
Laura Malo
Isaac Filella-Merce
Víctor Guallar
Alexis Molina
Re-assign community
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Papers citing
"Scoreformer: A Surrogate Model For Large-Scale Prediction of Docking Scores"
2 / 2 papers shown
Title
Graph Neural Networks with Learnable Structural and Positional Representations
Vijay Prakash Dwivedi
A. Luu
T. Laurent
Yoshua Bengio
Xavier Bresson
GNN
179
304
0
15 Oct 2021
Accelerating high-throughput virtual screening through molecular pool-based active learning
David E. Graff
E. Shakhnovich
Connor W. Coley
73
139
0
13 Dec 2020
1