Works matching DE "MOLECULAR dynamics"


Results: 5000
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    Prognostic Value of the TLM3 Biomarker Panel for Early Fibrosis Development in MASLD Within the General Population.

    Published in:
    Liver International, 2025, v. 45, n. 7, p. 1, doi. 10.1111/liv.70169
    By:
    • van Son, Koen C.;
    • de Jong, Jelle C. B. C.;
    • Özsezen, Serdar;
    • Caspers, Martien P. M.;
    • Augustijn, Quinten J. J.;
    • Snabel, Jessica;
    • Galenkamp, Henrike;
    • Hamer, Henrike M.;
    • van Dijk, Anne‐Marieke;
    • van Koppen, Arianne;
    • Mak, Anne Linde;
    • van den Born, Bert‐Jan;
    • Nieuwdorp, Max;
    • Drenth, Joost P. H.;
    • Gluud, Lise Lotte;
    • Tushuizen, Maarten E.;
    • Hanemaaijer, Roeland;
    • Verschuren, Lars;
    • Holleboom, Adriaan G.
    Publication type:
    Article
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    Synthesis, Biological Evaluation, Molecular Dynamics, and QM-MM Calculation of Spiro-Acridine Derivatives Against Leishmaniasis.

    Published in:
    Microorganisms, 2025, v. 13, n. 6, p. 1297, doi. 10.3390/microorganisms13061297
    By:
    • Albino, Sonaly;
    • Nobre, Michelangela;
    • da Silva, Jamire;
    • Reis, Malu dos;
    • Nascimento, Maria;
    • de Oliveira, Mayara;
    • Borges, Tatiana;
    • Albuquerque, Lucas;
    • Kuckelhaus, Selma;
    • Alves, Luis;
    • dos Santos, Fábio;
    • de Lima, Maria;
    • Nascimento, Igor;
    • da Silva, Teresinha;
    • de Moura, Ricardo
    Publication type:
    Article
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    Marine-Derived Peptides from Phaeodactylum tricornutum as Potential SARS-CoV-2 Mpro Inhibitors: An In Silico Approach.

    Published in:
    Microorganisms, 2025, v. 13, n. 6, p. 1271, doi. 10.3390/microorganisms13061271
    By:
    • Cañedo-Figueroa, David Mauricio;
    • Valdez-Flores, Marco Antonio;
    • Norzagaray-Valenzuela, Claudia Desireé;
    • Calderón-Zamora, Loranda;
    • Rábago-Monzón, Ángel Radamés;
    • Camberos-Barraza, Josué;
    • Guadrón-Llanos, Alma Marlene;
    • Herrán-Arita, Alberto Kousuke De la;
    • Picos-Cárdenas, Verónica Judith;
    • Camacho-Zamora, Alejandro;
    • Romero-Utrilla, Alejandra;
    • Cordero-Rivera, Carlos Daniel;
    • Ángel, Rosa María del;
    • León-Juárez, Moisés;
    • Reyes-Ruiz, José Manuel;
    • Farfan-Morales, Carlos Noe;
    • De Jesús-González, Luis Adrián;
    • Osuna-Ramos, Juan Fidel
    Publication type:
    Article
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    The Alkaloid Caulerpin Exhibits Potent and Selective Anti-Inflammatory Activity Through Interaction with the Glucocorticoid Receptor.

    Published in:
    Marine Drugs, 2025, v. 23, n. 6, p. 232, doi. 10.3390/md23060232
    By:
    • dos Santos, Jônatas Sousa Pires;
    • Silva, Dahara Keyse Carvalho;
    • da Silva Oliveira, Vanessa;
    • Junior, Sergio Santos Silva;
    • dos Santos Rodrigues, Edivaldo;
    • de Souza, Claudia Valeria Campos;
    • Martinez, Sabrina Teixeira;
    • Santos-Filho, Osvaldo Andrade;
    • Meira, Cássio Santana;
    • Soares, Milena Botelho Pereira
    Publication type:
    Article
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    3D-QSAR Design of New Bcr-Abl Inhibitors Based on Purine Scaffold and Cytotoxicity Studies on CML Cell Lines Sensitive and Resistant to Imatinib.

    Published in:
    Pharmaceuticals (14248247), 2025, v. 18, n. 6, p. 925, doi. 10.3390/ph18060925
    By:
    • Cabezas, David;
    • Delgado, Thalía;
    • Sepúlveda, Guisselle;
    • Krňávková, Petra;
    • Vojáčková, Veronika;
    • Kryštof, Vladimír;
    • Strnad, Miroslav;
    • Silva, Nicolás Ignacio;
    • Echeverría, Javier;
    • Espinosa-Bustos, Christian;
    • Mellado, Guido;
    • Luo, Jiao;
    • Mella, Jaime;
    • Salas, Cristian O.
    Publication type:
    Article
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