Adaptive Protein Design Protocols and Middleware

Computational protein design is experiencing a transformation driven by AI/ML. However, the range of potential protein sequences and structures is astronomically vast, even for moderately sized proteins. Hence, achieving convergence between generated and predicted structures demands substantial comp...

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Bibliographic Details

Published in:	2025 IEEE International Parallel and Distributed Processing Symposium Workshops (IPDPSW) pp. 1011 - 1015
Main Authors:	Alsaadi, Aymen, Ash, Jonathan, Titov, Mikhail, Turilli, Matteo, Merzky, Andre, Jha, Shantenu, Khare, Sagar
Format:	Conference Proceeding
Language:	English
Published:	IEEE 03.06.2025
Subjects:	Adaptation models Computational modeling Data models High performance computing hpc Machine learning machinelearning Middleware protein design Proteins Protocols Resource management Throughput workflows
ISSN:	2995-066X
Online Access:	Get full text
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