101 citations · 216 across the 10 of their papers we have counts for
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q-bio.BM2023★ 23 cited
Benchmarking Generated Poses: How Rational is Structure-based Drug Design with Generative Models?
Charles Harris, Kieran Didi, Arian R. Jamasb +4
Deep generative models for structure-based drug design (SBDD), where molecule generation is conditioned on a 3D protein pocket, have received considerable interest in recent years.…
cs.LG2023★ 7 cited
gRNAde: Geometric Deep Learning for 3D RNA inverse design
Chaitanya K. Joshi, Arian R. Jamasb, Ramon Viñas +5
Computational RNA design tasks are often posed as inverse problems, where sequences are designed based on adopting a single desired secondary structure without considering 3D confo…