137 citations · 183 across the 7 of their papers we have counts for
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q-bio.BM2021★ 17 cited
SHREC 2021: Retrieval and classification of protein surfaces equipped with physical and chemical properties
Andrea Raffo, Ulderico Fugacci, Silvia Biasotti +21
This paper presents the methods that have participated in the SHREC 2021 contest on retrieval and classification of protein surfaces on the basis of their geometry and physicochemi…
cs.DC2021★ 3 cited
Pandemic Drugs at Pandemic Speed: Infrastructure for Accelerating COVID-19 Drug Discovery with Hybrid Machine Learning- and Physics-based Simulations on High Performance Computers
Agastya P. Bhati, Shunzhou Wan, Dario Alfè +26
The race to meet the challenges of the global pandemic has served as a reminder that the existing drug discovery process is expensive, inefficient and slow. There is a major bottle…