Zobrazeno 1 - 5 of 5 pro vyhledávání: '"Taisung Lee"'
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AMBER Drug Discovery Boost Tools: Automated Workflow for Production Free-Energy Simulation Setup and Analysis (ProFESSA)
Autor: Darrin York, Taisung Lee, Abir Ganguly, Hsu-Chun Tsai, Mario Fernández-Pendás, Timothy Giese
Publikováno v: Journal of chemical information and modeling. 62(23)
We report an automated workflow for production free-energy simulation setup and analysis (ProFESSA) using the GPU-accelerated AMBER free-energy engine with enhanced sampling features and analysis tools, part of the AMBER Drug Discovery Boost package
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bcb101dae964ef5da4637246715c628c
https://pubmed.ncbi.nlm.nih.gov/36450130
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4
Multiple Property Tolerance Analysis for the Evaluation of Missense Mutations
Autor: Taisung Lee, Potts, Steven J., Mcginniss, Matthew J., Strom, Charles M.
Publikováno v: Web of Science
Evolutionary Bioinformatics, Vol 2, Pp 321-332 (2006)
Evolutionary Bioinformatics, Vol 2 (2006)
Computational prediction of the impact of a mutation on protein function is still not accurate enough for clinical diagnostics without additional human expert analysis. Sequence alignment-based methods have been extensively used but their results hig
Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2d53727c0d8cb05589460b9d58017b87
https://publons.com/wos-op/publon/54947510/
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