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Geometric deep learning for structure-based ligand design

AS Powers, HH Yu, P Suriana, RV Koodli… - ACS Central …, 2023 - ACS Publications
A pervasive challenge in drug design is determining how to expand a ligand─ a small
molecule that binds to a target biomolecule─ in order to improve various properties of the …
被引用次数：12 相关文章

Geometric Deep Learning for Structure-Based Ligand Design

AS Powers, HY Helen, P Suriana… - ACS central …, 2023 - pubmed.ncbi.nlm.nih.gov
A pervasive challenge in drug design is determining how to expand a ligand-a small
molecule that binds to a target biomolecule-in order to improve various properties of the …
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[HTML][HTML] Geometric Deep Learning for Structure-Based Ligand Design

AS Powers, HY Helen, P Suriana, RV Koodli… - ACS Central …, 2023 - ncbi.nlm.nih.gov
A pervasive challenge in drug design is determining how to expand a ligand a small
molecule that binds to a target biomolecule in order to improve various properties of the …

[引用][C] Geometric Deep Learning for Structure-Based Ligand Design

AS Powers, HH Yu, P Suriana, RV Koodli, T Lu… - ACS Central …, 2023 - par.nsf.gov

Geometric Deep Learning for Structure-Based Ligand Design

RO Dror, AS Powers, HY Helen, P Suriana… - ACS Central …, 2023 - search.proquest.com
A pervasive challenge in drug design is determining how to expand a ligand─ a small
molecule that binds to a target biomolecule─ in order to improve various properties of the …