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Grzybowski, Bartosz Andrzej
첨단연성물질 연구단
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Computer-generated "synthetic contingency" plans at times of logistics and supply problems: Scenarios for hydroxychloroquine and remdesivir

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Title
Computer-generated "synthetic contingency" plans at times of logistics and supply problems: Scenarios for hydroxychloroquine and remdesivir
Author(s)
Sara Szymkuć; Ewa P. Gajewska; Karol Molga; Agnieszka Wołos; Rafał Roszak; Wiktor Beker; Martyna Moskal; Piotr Dittwald; Bartosz A. Grzybowski
Subject
PILOT-SCALE PROCESS, ; OPTIMIZATION
Publication Date
2020-07
Journal
CHEMICAL SCIENCE, v.11, no.26, pp.6736 - 6744
Publisher
ROYAL SOC CHEMISTRY
Abstract
© The Royal Society of Chemistry. A computer program for retrosynthetic planning helps develop multiple "synthetic contingency"plans for hydroxychloroquine and also routes leading to remdesivir, both promising but yet unproven medications against COVID-19. These plans are designed to navigate, as much as possible, around known and patented routes and to commence from inexpensive and diverse starting materials, so as to ensure supply in case of anticipated market shortages of commonly used substrates. Looking beyond the current COVID-19 pandemic, development of similar contingency syntheses is advocated for other already-approved medications, in case such medications become urgently needed in mass quantities to face other public-health emergencies
URI
https://pr.ibs.re.kr/handle/8788114/7779
DOI
10.1039/d0sc01799j
ISSN
2041-6520
Appears in Collections:
Center for Soft and Living Matter(첨단연성물질 연구단) > 1. Journal Papers (저널논문)
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