Zobrazeno 1 - 10
of 35
pro vyhledávání: '"Qinfang Sun"'
Publikováno v:
Viruses, Vol 16, Iss 1, p 76 (2024)
The first- and second-generation clinically used HIV-1 integrase (IN) strand transfer inhibitors (INSTIs) are key components of antiretroviral therapy (ART), which work by blocking the integration step in the HIV-1 replication cycle that is catalyzed
Externí odkaz:
https://doaj.org/article/4cf5d25e025f486ba1df67ffec6b8500
Autor:
Qinfang Sun, Ronald M. Levy, Karen A. Kirby, Zhengqiang Wang, Stefan G. Sarafianos, Nanjie Deng
Publikováno v:
Viruses, Vol 13, Iss 5, p 920 (2021)
While drug resistance mutations can often be attributed to the loss of direct or solvent-mediated protein−ligand interactions in the drug-mutant complex, in this study we show that a resistance mutation for the picomolar HIV-1 capsid (CA)-targeting
Externí odkaz:
https://doaj.org/article/c8b17cfcdf6b46e4aa486a13d0012ca3
Autor:
Min Li, Dario Oliveira Passos, Zelin Shan, Steven J. Smith, Qinfang Sun, Avik Biswas, Indrani Choudhuri, Timothy S. Strutzenberg, Allan Haldane, Nanjie Deng, Zhaoyang Li, Xue Zhi Zhao, Terrence R. Burke, Ronald M. Levy, Stephen H. Hughes, Robert Craigie, Dmitry Lyumkis
HIV-1 infection depends on the integration of viral DNA into host chromatin. Integration is mediated by the viral enzyme integrase and is blocked by integrase strand transfer inhibitors (INSTIs), first-line antiretroviral therapeutics widely used in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::b022e35fdbb4b4f0aca4b1b42b17445a
https://doi.org/10.1101/2022.12.04.519057
https://doi.org/10.1101/2022.12.04.519057
Publikováno v:
Protein Sci
Targeting protein-protein interactions for therapeutic development involves designing small molecules to either disrupt or enhance a known PPI. For this purpose, it is necessary to compute reliably the effect of chemical modifications of small molecu
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::7c9f777728ee47be4de505000d60dc23
https://doi.org/10.1002/pro.4004
https://doi.org/10.1002/pro.4004
Publikováno v:
Crystal Growth & Design. 20:2251-2265
Selection of a diverse set of solvents is important for systematic investigation of polymorph landscape and quick identification of the stable polymorph. The diversity of selected solvents is usual...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f8b547c61b54c36c0bf116b766b04421
https://doi.org/10.1021/acs.cgd.9b01380
https://doi.org/10.1021/acs.cgd.9b01380
Autor:
Qinfang Sun, Avik Biswas, R. S. K. Vijayan, Pierrick Craveur, Stefano Forli, Arthur J. Olson, Andres Emanuelli Castaner, Karen A. Kirby, Stefan G. Sarafianos, Nanjie Deng, Ronald Levy
Publikováno v:
Journal of computer-aided molecular design. 36(3)
We have identified novel HIV-1 capsid inhibitors targeting the PF74 binding site. Acting as the building block of the HIV-1 capsid core, the HIV-1 capsid protein plays an important role in the viral life cycle and is an attractive target for antivira
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f3aa50f0fdb65eed3ee21c2d9c5a87cb
https://pubmed.ncbi.nlm.nih.gov/35262811
https://pubmed.ncbi.nlm.nih.gov/35262811
Autor:
Karen A. Kirby, Nanjie Deng, Qinfang Sun, Stefan G. Sarafianos, Zhengqiang Wang, Ronald M. Levy
Publikováno v:
Viruses, Vol 13, Iss 920, p 920 (2021)
Viruses
Volume 13
Issue 5
Viruses
Volume 13
Issue 5
While drug resistance mutations can often be attributed to the loss of direct or solvent-mediated protein−ligand interactions in the drug-mutant complex, in this study we show that a resistance mutation for the picomolar HIV-1 capsid (CA)-targeting
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::1c884cc32b174fd545046fb9e07fdf6d
https://www.mdpi.com/1999-4915/13/5/920
https://www.mdpi.com/1999-4915/13/5/920
Publikováno v:
The Journal of Physical Chemistry C. 122:23230-23241
We have performed density functional theory calculations to investigate the convergence of reaction barriers with respect to zeolite cluster size, for multistep reactions catalyzed in HZSM-5. We constructed cluster models of HZSM-5 using the delta-cl
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::f3192cb737e84e95b9027b52fc58e237
https://doi.org/10.1021/acs.jpcc.8b08684
https://doi.org/10.1021/acs.jpcc.8b08684
Publikováno v:
Journal of Environmental Management. 126:174-181
We determined the effects of nitrification capacity and environmental factors on landfill methane oxidation potential (MOP) using an aged refuse in laboratory batch assays and compared it with two different types of soils. The nitrogen conversion in
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f4763fab9437893eed8239c0bbba8bce
https://doi.org/10.1016/j.jenvman.2013.03.017
https://doi.org/10.1016/j.jenvman.2013.03.017
Publikováno v:
The journal of physical chemistry. B. 120(39)
We simulated the dynamics of azole groups (pyrazole, imidazole, 1,2,3-triazole, 1,2,4-triazole, and tetrazole) as neat liquids and tethered via linkers to aliphatic backbones to determine how tethering and varying functional groups affect hydrogen bo
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::cd82aa9a3a959c9685bb602019464980
https://pubmed.ncbi.nlm.nih.gov/27632578
https://pubmed.ncbi.nlm.nih.gov/27632578