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  1. Article ; Online: Molecular characterization of

    Hu Frisk, Junmei / Wang, Liya

    Nucleosides, nucleotides & nucleic acids

    2024  , Page(s) 1–9

    Abstract: ... ...

    Abstract Drosophila
    Language English
    Publishing date 2024-03-22
    Publishing country United States
    Document type Journal Article
    ZDB-ID 2008956-9
    ISSN 1532-2335 ; 1525-7770
    ISSN (online) 1532-2335
    ISSN 1525-7770
    DOI 10.1080/15257770.2024.2332410
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    In stock of ZB MED Cologne/Königswinter

    Zs.A 3870: Show issues Location:
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  2. Article: Editorial:

    Wang, Junmei / Blount, Paul / Hou, Tingjun / Sokabe, Masahiro

    Frontiers in chemistry

    2024  Volume 12, Page(s) 1376617

    Language English
    Publishing date 2024-02-09
    Publishing country Switzerland
    Document type Editorial
    ZDB-ID 2711776-5
    ISSN 2296-2646
    ISSN 2296-2646
    DOI 10.3389/fchem.2024.1376617
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  3. Article ; Online: Metarhizium robertsii.

    Shang, Junmei / Song, Shuangxiu / Wang, Chengshu

    Trends in parasitology

    2023  Volume 40, Issue 2, Page(s) 192–193

    MeSH term(s) Metarhizium ; Virulence
    Language English
    Publishing date 2023-11-20
    Publishing country England
    Document type Journal Article
    ZDB-ID 2036227-4
    ISSN 1471-5007 ; 1471-4922
    ISSN (online) 1471-5007
    ISSN 1471-4922
    DOI 10.1016/j.pt.2023.10.004
    Database MEDical Literature Analysis and Retrieval System OnLINE

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    In stock of ZB MED Cologne/Königswinter

    Zs.B 2898: Show issues Location:
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    Zs.MG 16: Show issues
    Zs.MO 251: Show issues

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  4. Article: Preparation of Phosphorylated

    Fan, Wenguang / Jiang, Xintong / Li, Qinyang / Wang, Jiansheng / Lv, Minghui / Liu, Junmei

    Foods (Basel, Switzerland)

    2024  Volume 13, Issue 2

    Abstract: In this study, ...

    Abstract In this study,
    Language English
    Publishing date 2024-01-20
    Publishing country Switzerland
    Document type Journal Article
    ZDB-ID 2704223-6
    ISSN 2304-8158
    ISSN 2304-8158
    DOI 10.3390/foods13020335
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  5. Article: Different effects of TCBPA exposure on liver cancer cells and liver cells: two sides of the coin.

    Wang, Xiaobo / Ye, Xuxing / Chen, Yanping / Lin, Junmei

    American journal of cancer research

    2024  Volume 14, Issue 3, Page(s) 1363–1375

    Abstract: Tetrachlorobisphenol A (TCBPA), widely used as a substitute for tetrabromobisphenol A (TBBPA), has been detected in various environmental media. Therefore, a detailed evaluation of the toxicological properties of TCBPA is necessary. In this study, we ... ...

    Abstract Tetrachlorobisphenol A (TCBPA), widely used as a substitute for tetrabromobisphenol A (TBBPA), has been detected in various environmental media. Therefore, a detailed evaluation of the toxicological properties of TCBPA is necessary. In this study, we used hepatoma and normal liver cell models
    Language English
    Publishing date 2024-03-15
    Publishing country United States
    Document type Journal Article
    ZDB-ID 2589522-9
    ISSN 2156-6976
    ISSN 2156-6976
    DOI 10.62347/YSXW8940
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  6. Article ; Online: Fast Identification of Possible Drug Treatment of Coronavirus Disease -19 (COVID-19) Through Computational Drug Repurposing Study.

    Wang, Junmei

    ChemRxiv : the preprint server for chemistry

    2020  

    Abstract: The recent outbreak of novel coronavirus disease -19 (COVID-19) calls for and welcomes possible treatment strategies using drugs on the market. It is very efficient to apply computer-aided drug design techniques to quickly identify promising drug ... ...

    Abstract The recent outbreak of novel coronavirus disease -19 (COVID-19) calls for and welcomes possible treatment strategies using drugs on the market. It is very efficient to apply computer-aided drug design techniques to quickly identify promising drug repurposing candidates, especially after the detailed 3D-structures of key virous proteins are resolved. Taking the advantage of a recently released crystal structure of COVID-19 protease in complex with a covalently-bonded inhibitor, N3,
    Keywords covid19
    Language English
    Publishing date 2020-02-21
    Publishing country United States
    Document type Preprint
    ISSN 2573-2293
    ISSN (online) 2573-2293
    DOI 10.26434/chemrxiv.11875446.v1
    Database MEDical Literature Analysis and Retrieval System OnLINE

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  7. Book ; Online: Fast Identification of Possible Drug Treatment of Coronavirus Disease -19 (COVID-19) Through Computational Drug Repurposing Study

    Junmei Wang

    2020  

    Abstract: The recent outbreak of novel coronavirus disease -19 (COVID-19) calls for and welcomes possible treatment strategies using drugs on the market. It is very efficient to apply computer-aided drug design techniques to quickly identify promising drug ... ...

    Abstract The recent outbreak of novel coronavirus disease -19 (COVID-19) calls for and welcomes possible treatment strategies using drugs on the market. It is very efficient to apply computer-aided drug design techniques to quickly identify promising drug repurposing candidates, especially after the detailed 3D-structures of key virous proteins are resolved. Taking the advantage of a recently released crystal structure of COVID-19 protease in complex with a covalently-bonded inhibitor, N3, 1 I conducted virtual docking screening of approved drugs and drug candidates in clinical trials. For the top docking hits, I then performed molecular dynamics simulations followed by binding free energy calculations using an endpoint method called MM-PBSA-WSAS. 2-4 Several promising known drugs stand out as potential inhibitors of COVID-19 protease, including Carfilzomib, Eravacycline, Valrubicin, Lopinavir and Elbasvir. Carfilzomib, an approved anti-cancer drug acting as a proteasome inhibitor, has the best MM-PBSA-WSAS binding free energy, -13.82 kcal/mol. Streptomycin, an antibiotic and a charged molecule, also demonstrates some inhibitory effect, even though the predicted binding free energy of the charged form (-3.82 kcal/mol) is not nearly as low as that of the neutral form (-7.92 kcal/mol). One bioactive, PubChem 23727975, has a binding free energy of -12.86 kcal/mol. Detailed receptor-ligand interactions were analyzed and hot spots for the receptor-ligand binding were identified. I found that one hotspot residue HIS41, is a conserved residue across many viruses including COVID-19, SARS, MERS, and HCV. The findings of this study can facilitate rational drug design targeting the COVID-19 protease.
    Keywords Computational Chemistry and Modeling ; Theory - Computational ; Chemoinformatics - Computational Chemistry ; COVID2019 ; drug repurposing screens ; MM-PBSA-WSAS ; Virtual Screening ; Binding Free Energy Calculation ; covid19
    Subject code 540
    Publishing date 2020-02-21T06:21:22Z
    Document type Book ; Online
    Database BASE - Bielefeld Academic Search Engine (life sciences selection)

    Full text online

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  8. Article ; Online: Fights on the surface prior to fungal invasion of insects.

    Shang, Junmei / Hong, Song / Wang, Chengshu

    PLoS pathogens

    2024  Volume 20, Issue 2, Page(s) e1011994

    Abstract: Entomopathogenic fungi (EPF) infect insects by landing on and penetrating cuticles. Emerging evidence has shown that, prior to the invasion of insects, fungal cells have to battle and overcome diverse challenges, including the host behavioral defenses, ... ...

    Abstract Entomopathogenic fungi (EPF) infect insects by landing on and penetrating cuticles. Emerging evidence has shown that, prior to the invasion of insects, fungal cells have to battle and overcome diverse challenges, including the host behavioral defenses, colonization resistance mediated by ectomicrobiotas, host recognition, and generation of enough penetration pressure. The ascomycete EPF such as Metarhizium and Beauveria can thus produce adhesive proteins and/or the exopolysaccharide mucilage to tightly glue fungal cells on cuticles. Producing antimicrobial peptides and chemical compounds can enable EPF to outcompete cuticular defensive microbes. The use of divergent membrane receptors, accumulation, and quick degradation of lipid droplets in conidial cells can help EPF recognize proper hosts and build up cellular turgor to breach cuticles for systematic invasion. Further investigations are still required to unveil the multifaceted and intricate relationships between EPF and insect hosts.
    MeSH term(s) Animals ; Insecta/microbiology ; Metarhizium ; Beauveria ; Ascomycota ; Spores, Fungal
    Language English
    Publishing date 2024-02-22
    Publishing country United States
    Document type Journal Article
    ZDB-ID 2205412-1
    ISSN 1553-7374 ; 1553-7374
    ISSN (online) 1553-7374
    ISSN 1553-7374
    DOI 10.1371/journal.ppat.1011994
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  9. Article ; Online: Fast Identification of Possible Drug Treatment of Coronavirus Disease-19 (COVID-19) through Computational Drug Repurposing Study.

    Wang, Junmei

    Journal of chemical information and modeling

    2020  Volume 60, Issue 6, Page(s) 3277–3286

    Abstract: ... molecular mechanics/Poisson-Boltzmann surface area/weighted solvent-accessible surface area; Wang, ...

    Abstract The recent outbreak of novel coronavirus disease-19 (COVID-19) calls for and welcomes possible treatment strategies using drugs on the market. It is very efficient to apply computer-aided drug design techniques to quickly identify promising drug repurposing candidates, especially after the detailed 3D structures of key viral proteins are resolved. The virus causing COVID-19 is SARS-CoV-2. Taking advantage of a recently released crystal structure of SARS-CoV-2 main protease in complex with a covalently bonded inhibitor, N3 (Liu et al., 10.2210/pdb6LU7/pdb), I conducted virtual docking screening of approved drugs and drug candidates in clinical trials. For the top docking hits, I then performed molecular dynamics simulations followed by binding free energy calculations using an end point method called MM-PBSA-WSAS (molecular mechanics/Poisson-Boltzmann surface area/weighted solvent-accessible surface area; Wang,
    MeSH term(s) Anti-Bacterial Agents/chemistry ; Anti-Bacterial Agents/pharmacology ; Betacoronavirus/chemistry ; Betacoronavirus/drug effects ; Betacoronavirus/enzymology ; COVID-19 ; Coronavirus 3C Proteases ; Coronavirus Infections/drug therapy ; Coronavirus Infections/virology ; Cysteine Endopeptidases/chemistry ; Cysteine Endopeptidases/metabolism ; Drug Repositioning/economics ; Drug Repositioning/methods ; Humans ; Molecular Docking Simulation ; Molecular Dynamics Simulation ; Oligopeptides/chemistry ; Oligopeptides/pharmacology ; Pandemics ; Pneumonia, Viral/drug therapy ; Pneumonia, Viral/virology ; Protease Inhibitors/chemistry ; Protease Inhibitors/pharmacology ; SARS-CoV-2 ; Tetracyclines/chemistry ; Tetracyclines/pharmacology ; Thermodynamics ; Time Factors ; Viral Nonstructural Proteins/antagonists & inhibitors ; Viral Nonstructural Proteins/chemistry ; Viral Nonstructural Proteins/metabolism
    Chemical Substances Anti-Bacterial Agents ; Oligopeptides ; Protease Inhibitors ; Tetracyclines ; Viral Nonstructural Proteins ; eravacycline (07896928ZC) ; carfilzomib (72X6E3J5AR) ; Cysteine Endopeptidases (EC 3.4.22.-) ; Coronavirus 3C Proteases (EC 3.4.22.28)
    Keywords covid19
    Language English
    Publishing date 2020-05-04
    Publishing country United States
    Document type Journal Article ; Research Support, N.I.H., Extramural
    ZDB-ID 190019-5
    ISSN 1549-960X ; 0095-2338
    ISSN (online) 1549-960X
    ISSN 0095-2338
    DOI 10.1021/acs.jcim.0c00179
    Database MEDical Literature Analysis and Retrieval System OnLINE

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    Zs.A 1230: Show issues Location:
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  10. Article ; Online: Expression of Concern: Surface modification of intraocular lenses

    Tang, Junmei / Liu, Sihao / Han, Yuemei / Wang, Rui / Xia, Jiayi / Chen, Hao / Lin, Quankui

    Journal of materials chemistry. B

    2024  Volume 12, Issue 12, Page(s) 3161

    Abstract: Expression of Concern for 'Surface modification of intraocular ... ...

    Abstract Expression of Concern for 'Surface modification of intraocular lenses
    Language English
    Publishing date 2024-03-20
    Publishing country England
    Document type Expression of Concern
    ZDB-ID 2702241-9
    ISSN 2050-7518 ; 2050-750X
    ISSN (online) 2050-7518
    ISSN 2050-750X
    DOI 10.1039/d4tb90050b
    Database MEDical Literature Analysis and Retrieval System OnLINE

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