Výsledky vyhledávání - Bio-computational modeling

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  1. 1

    Bio-computational modeling, POM analysis and molecular dynamic simulation for novel synthetic quinolone and benzo[d][1,3]oxazine candidates as antimicrobial inhibitors Autor Elsayed, Doaa A., Abdu, Mohamed E., Marzouk, Mohammed A., Mahmoud, Elsayed M., El-Shwiniy, Walaa H., Spring, Andrew M., Shehab, Wesam S.

    ISSN: 2045-2322, 2045-2322
    Vydáno: London Nature Publishing Group UK 20.11.2024
    Vydáno v Scientific reports (20.11.2024)
    “…The current study offers a metal-free, direct, and successful synthesis technique for a new series of quinolinone and benzo[d][1,3]oxazine, along with an…”
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    Bio-computational modeling, POM analysis and molecular dynamic simulation for novel synthetic quinolone and benzod1,3oxazine candidates as antimicrobial inhibitors Autor Elsayed, Doaa A, Abdu, Mohamed E, Marzouk, Mohammed A, Mahmoud, Elsayed M, El-Shwiniy, Walaa H, Spring, Andrew M, Shehab, Wesam S

    ISSN: 2045-2322, 2045-2322
    Vydáno: 20.11.2024
    Vydáno v Scientific reports (20.11.2024)
    “…The current study offers a metal-free, direct, and successful synthesis technique for a new series of quinolinone and benzo[d][1,3]oxazine, along with an…”
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    Design, synthesis, biological evaluation, and bio-computational modeling of imidazo, thieno, pyrimidopyrimidine, pyrimidodiazepene, and motifs as antimicrobial agents Autor El-Ahwany Maged F., Assy Mohamed G., Sherif Mohamed H., Soliman Mohamed R., Titi Abderrahim, Touzani Rachid, El-Gendey Marwa S., Shehab Wesam S., Abdellattif Magda H.

    ISSN: 0793-0283, 2191-0197
    Vydáno: Berlin Walter de Gruyter GmbH 01.01.2023
    Vydáno v Heterocyclic Communications (01.01.2023)
    “…In the drug chemistry industry, synthesizing a talented exclusive series of aza-polyheterocyclic compounds was crucial. Aminopyrimidine nucleus reacted with…”
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    Investigating Impact of Current Pulse Waveform and Simulation Frequency on Deep Brain Stimulation Autor Salkım, Enver

    ISSN: 2822-2881, 2822-2881
    Vydáno: Firat University 18.02.2025
    “…Bio-computational models have a significant impact on the design and development of medical devices…”
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    Unfolding the prospects of computational (bio)materials modeling Autor Sevink, G J Agur, Liwo, Jozef Adam, Asinari, Pietro, MacKernan, Donal, Milano, Giuseppe, Pagonabarraga, Ignacio

    ISSN: 1089-7690, 1089-7690
    Vydáno: 14.09.2020
    Vydáno v The Journal of chemical physics (14.09.2020)
    “…In this perspective communication, we briefly sketch the current state of computational (bio)material research and discuss possible solutions for the four…”
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    Computational modeling of biomechanics and biorheology of heated red blood cells Autor Liu, Zixiang Leonardo, Li, He, Qiang, Yuhao, Buffet, Pierre, Dao, Ming, Karniadakis, George Em

    ISSN: 1542-0086, 1542-0086
    Vydáno: 02.11.2021
    Vydáno v Biophysical journal (02.11.2021)
    “…Because of their compromised deformability, heat denatured erythrocytes have been used as labeled probes to visualize spleen tissue or to assess the ability of…”
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    Computational modeling of vacuum-assisted delivery: biomechanics of maternal soft tissues: Computational modeling of vacuum-assisted delivery: biomechanics of maternal soft tissues Autor Moura, Rita, Oliveira, Dulce A., Kimmich, Nina, Jorge, Renato M. Natal, Parente, Marco P. L.

    ISSN: 1617-7959, 1617-7940, 1617-7940
    Vydáno: Berlin/Heidelberg Springer Berlin Heidelberg 01.08.2025
    “…Childbirth is a complex process influenced by physiological, mechanical, and hormonal factors. While natural vaginal delivery is the safest, it is not always…”
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    Computational modeling in bioengineering and bioinformatics Autor Filipovic, Nenad

    ISBN: 9780128195833, 0128195835
    Vydáno: London ; San Diego Academic Press 2020
    “…Computational Modeling in Bioengineering and Bioinformatics promotes complementary disciplines that hold great promise for the advancement of research and development in complex medical and biological…”
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    E-kniha Kniha
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    The study of G‐protein coupled receptor oligomerization with computational modeling and bioinformatics Autor Filizola, Marta, Weinstein, Harel

    ISSN: 1742-464X, 1742-4658
    Vydáno: Oxford, UK Blackwell Science Ltd 01.06.2005
    Vydáno v The FEBS journal (01.06.2005)
    “…‐order oligomers. Approaches and tools offered by bioinformatics can be used to reduce the complexity of this task and, combined with computational modeling, can serve to yield testable predictions for the structural…”
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    Mass Spectrometric and Bio-Computational Binding Strength Analysis of Multiply Charged RNAse S Gas-Phase Complexes Obtained by Electrospray Ionization from Varying In-Solution Equilibrium Conditions Autor Koy, Cornelia, Opuni, Kwabena F. M., Danquah, Bright D., Neamtu, Andrei, Glocker, Michael O.

    ISSN: 1422-0067, 1661-6596, 1422-0067
    Vydáno: Basel MDPI AG 01.10.2021
    “…We investigated the influence of a solvent’s composition on the stability of desorbed and multiply charged RNAse S ions by analyzing the non-covalent complex’s…”
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    Computational Modelling of Biomechanics and Biotribology in the Musculoskeletal System - Biomaterials and Tissues (2nd Edition) Autor Jin, Z, Li, Junyan, Chen, Zhenxian

    ISBN: 0128195312, 9780128195314
    Vydáno: Chantilly Elsevier 2021
    “…, the fundamentals of computational modeling of biomechanics in the musculoskeletal system, finite element modeling…”
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    Computational Modeling of bio-MOFs for CO2/CH4 separations Autor Erucar, Ilknur, Keskin, Seda

    ISSN: 0009-2509, 1873-4405
    Vydáno: Elsevier Ltd 07.07.2015
    Vydáno v Chemical engineering science (07.07.2015)
    “…Bio-metal organic frameworks (Bio-MOFs), composed of biocompatible metal cations and linker molecules such as amino acids, nucleobases and sugars, are…”
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    Computational biomedical modeling and screening for prediction of molecular mechanisms of Simiao Pill against hyperuricemia Autor Chen, Qinghong, Chen, Xiaomei, Chen, Xiaohu, Li, Mingdi, Komori, Akari, Sun, Xiaomin, Liu, Yanyan, Wei Hong Yang, Angela, Hung, Andrew, Zhao, Xiaoshan, Li, Hong

    ISSN: 0167-7322, 1873-3166
    Vydáno: Elsevier B.V 01.07.2023
    Vydáno v Journal of molecular liquids (01.07.2023)
    “… Nonetheless, the mechanisms underlying SMP against HUA remain unclear. We employed computational biomedical modeling and screening to explore the potential pharmacodynamic components and the mechanisms of SMP for HUA…”
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    Effects of Plate‐Bone Contact on Bridge Plate Fracture Fixation Biomechanics: Computational, Experimental, and Analytical Modeling Autor Koroneos, Zachary A., Wee, Hwabok, Reid, J. Spence, Lewis, Gregory S.

    ISSN: 0736-0266, 1554-527X, 1554-527X
    Vydáno: United States John Wiley and Sons Inc 01.09.2025
    Vydáno v Journal of orthopaedic research (01.09.2025)
    “…Bridge plating is commonly used for internal fixation of comminuted fractures. The inner working length between screws has been established as a key parameter…”
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    Toward Good Simulation Practice: Best Practices for the Use of Computational Modelling and Simulation in the Regulatory Process of Biomedical Products Autor Viceconti, Marco, Emili, Luca

    ISBN: 9783031482847, 3031482832, 3031482840, 9783031482830
    Vydáno: Cham Springer Nature 2024
    “…This open access book, the Community of Practice led by the VPH Institute, the Avicenna Alliance, and the In Silico World consortium has brought together 138…”
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    Computational Modeling in Biomedical Engineering and Medical Physics Autor Morega, Alexandru, Morega, Mihaela, Dobre, Alin

    ISBN: 9780128178973, 0128178973
    Vydáno: London Elsevier 2021
    “…Mathematical and numerical modelling of engineering problems in medicine is aimed at unveiling and understanding multidisciplinary interactions and processes and providing insights useful to clinical…”
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    Glioma-Targeted Therapeutics: Computer-Aided Drug Design Prospective Autor Poonan, Preantha, Agoni, Clement, Ibrahim, Mahmoud A. A., Soliman, Mahmoud E. S.

    ISSN: 1572-3887, 1875-8355, 1573-4943, 1875-8355
    Vydáno: New York Springer US 01.10.2021
    Vydáno v The Protein Journal (01.10.2021)
    “…Amongst the several types of brain cancers known to humankind, glioma is one of the most severe and life-threatening types of cancer, comprising 40% of all…”
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    Computational modeling and bioinformatic analyses of functional mutations in drug target genes in Mycobacterium tuberculosis Autor Singh, Pooja, Jamal, Salma, Ahmed, Faraz, Saqib, Najumu, Mehra, Seema, Ali, Waseem, Roy, Deodutta, Ehtesham, Nasreen Z., Hasnain, Seyed E.

    ISSN: 2001-0370, 2001-0370
    Vydáno: Elsevier B.V 01.01.2021
    “…[Display omitted] •MycoTRAP-DB, a database of mutations and their impact on normal functionality of protein in M.tb genes.•Several secondary mutations were…”
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