Zika Virus ; Discovering Effective Protease Inhibitors via Template-Based Modeling

Zika Virus ; Discovering Effective Protease Inhibitors via Template-Based Modeling

썸네일 Challenge 애게서 업로드 하였습니다. 17. 8. 11 오전 11:29
평균 (0 투표)
The Zika virus, which is a member of the flavivirus genus, poses a serious threat to humanity because there is no vaccine or cure. Zika is suspected to cause microcephaly, and it is rapidly spreading throughout parts of Brazil. Surprisingly, there are no known protein structures for the virus which are essential for drug and vaccine development. This paper investigates the Zika virus’s nonstructural proteins with template-based modeling by using GalaxyTBM/Refine/SC. GalaxyDock was used to examine the effectiveness of various known serine protease inhibitors in inhibiting the Zika viral protease. In testing five inhibitors, Kunitz soybean trypsin inhibitor showed the strongest binding affinity (-10.082 kcal/mol). This paper provides a rudimentary foundation for further drug discovery research regarding the Zika virus.
경진대회: 계산화학 계산화학 » 5회 경진대회
태그: galaxydock galaxytbm galaxyrefine
1 Of 4
코멘트
아직 코멘트가 없습니다. Please sign in to comment.

버전 1.2

EDISON Test가 마지막으로 수정함
17. 8. 29 오후 12:58
상태: 승인됨
The Zika virus, which is a member of the flavivirus genus, poses a serious threat to humanity because there is no vaccine or cure. Zika is suspected to cause microcephaly, and it is rapidly spreading throughout parts of Brazil. Surprisingly, there are no known protein structures for the virus which are essential for drug and vaccine development. This paper investigates the Zika virus’s nonstructural proteins with template-based modeling by using GalaxyTBM/Refine/SC. GalaxyDock was used to examine the effectiveness of various known serine protease inhibitors in inhibiting the Zika viral protease. In testing five inhibitors, Kunitz soybean trypsin inhibitor showed the strongest binding affinity (-10.082 kcal/mol). This paper provides a rudimentary foundation for further drug discovery research regarding the Zika virus.
다운로드 (799k) URL 또는 Webdav URL 가져오기
버전 히스토리
버전 날짜 크기  
1.2 4 년 전 799k
1.1 4 년 전 984k
1.0 4 년 전 799k