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Chemoinformatics and artificial intelligence colloquium: progress and challenges in developing bioactive compounds.
J Cheminform. 2022 Dec 2;14(1):82. doi: 10.1186/s13321-022-00661-0.
J Cheminform. 2022.
PMID: 36461094
Free PMC article.
A Fragment Library of Natural Products and its Comparative Chemoinformatic Characterization.
Chávez-Hernández AL, Sánchez-Cruz N, Medina-Franco JL.
Chávez-Hernández AL, et al.
Mol Inform. 2020 Nov;39(11):e2000050. doi: 10.1002/minf.202000050. Epub 2020 Apr 29.
Mol Inform. 2020.
PMID: 32302465
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Fragment Library of Natural Products and Compound Databases for Drug Discovery.
Chávez-Hernández AL, Sánchez-Cruz N, Medina-Franco JL.
Chávez-Hernández AL, et al.
Biomolecules. 2020 Nov 6;10(11):1518. doi: 10.3390/biom10111518.
Biomolecules. 2020.
PMID: 33172012
Free PMC article.
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Computational Applications in Secondary Metabolite Discovery (CAiSMD): an online workshop.
Ntie-Kang F, Telukunta KK, Fobofou SAT, Chukwudi Osamor V, Egieyeh SA, Valli M, Djoumbou-Feunang Y, Sorokina M, Stork C, Mathai N, Zierep P, Chávez-Hernández AL, Duran-Frigola M, Babiaka SB, Tematio Fouedjou R, Eni DB, Akame S, Arreyetta-Bawak AB, Ebob OT, Metuge JA, Bekono BD, Isa MA, Onuku R, Shadrack DM, Musyoka TM, Patil VM, van der Hooft JJJ, da Silva Bolzani V, Medina-Franco JL, Kirchmair J, Weber T, Tastan Bishop Ö, Medema MH, Wessjohann LA, Ludwig-Müller J.
Ntie-Kang F, et al. Among authors: chavez hernandez al.
J Cheminform. 2021 Sep 6;13(1):64. doi: 10.1186/s13321-021-00546-8.
J Cheminform. 2021.
PMID: 34488889
Free PMC article.
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Towards the De Novo Design of HIV-1 Protease Inhibitors Based on Natural Products.
Chávez-Hernández AL, Juárez-Mercado KE, Saldívar-González FI, Medina-Franco JL.
Chávez-Hernández AL, et al.
Biomolecules. 2021 Dec 1;11(12):1805. doi: 10.3390/biom11121805.
Biomolecules. 2021.
PMID: 34944448
Free PMC article.
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Chemical Multiverse: An Expanded View of Chemical Space.
Medina-Franco JL, Chávez-Hernández AL, López-López E, Saldívar-González FI.
Medina-Franco JL, et al. Among authors: chavez hernandez al.
Mol Inform. 2022 Nov;41(11):e2200116. doi: 10.1002/minf.202200116. Epub 2022 Aug 23.
Mol Inform. 2022.
PMID: 35916110
Free PMC article.
Review.
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Art driven by visual representations of chemical space.
Gaytán-Hernández D, Chávez-Hernández AL, López-López E, Miranda-Salas J, Saldívar-González FI, Medina-Franco JL.
Gaytán-Hernández D, et al. Among authors: chavez hernandez al.
J Cheminform. 2023 Oct 21;15(1):100. doi: 10.1186/s13321-023-00770-4.
J Cheminform. 2023.
PMID: 37865794
Free PMC article.
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Chemical Multiverse and Diversity of Food Chemicals.
Avellaneda-Tamayo JF, Chávez-Hernández AL, Prado-Romero DL, Medina-Franco JL.
Avellaneda-Tamayo JF, et al. Among authors: chavez hernandez al.
J Chem Inf Model. 2024 Feb 26;64(4):1229-1244. doi: 10.1021/acs.jcim.3c01617. Epub 2024 Feb 14.
J Chem Inf Model. 2024.
PMID: 38356237
Free PMC article.
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