Showing 81 - 100 results of 3,599 for search '"ADME', query time: 0.09s Refine Results
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    In Silico, SwissADME, and DFT Studies of Newly Synthesized Oxindole Derivatives Followed by Antioxidant Studies by Abdur Rauf, Haroon Khan, Momin Khan, Ali Abusharha, Goncagül Serdaroğlu, Maria Daglia

    Published 2023-01-01
    “…Additionally, in silico ADME studies indicated that C-1 and C-2 with 1,1 rotatable bonds could have moderate water solubility and therefore could have the potential ability to cross the blood-brain barrier. …”
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    Article
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    Antiproliferative Activities and SwissADME Predictions of Physicochemical Properties of Carbonyl Group‐Modified Rotenone Analogues by Rajelle D. Hernandez, Frances Abygail F. Genio, Jannelle R. Casanova, Dr. Marlon T. Conato, Dr. Monissa C. Paderes

    Published 2024-01-01
    “…Specifically, the oxime and alcohol rotenone derivatives exhibited antiproliferative activities against all 3 cancer cell lines, while the ethoxy, carbamate, and alkene derivatives are selective against MCF‐7 (IC50=5.72 μM), HCT116 (IC50=8.86 μM), and A549 (IC50=0.11 μM), respectively. SwissADME analysis showed that the physicochemical properties and drug‐likeness of the synthesized rotenone derivatives were within the set limits, suggesting the favorable characteristics of these compounds for drug development. …”
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    ADM-CLE approach for detecting slow variables in continuous time Markov chains and dynamic data by Cucuringu, M, Erban, R

    Published 2015
    “…The resulting approach, called ADM-CLE, has the potential of being more efficient than the ADM method for a large class of chemical reaction systems, because it replaces the computationally most expensive step of ADM (running local short bursts of simulations) by using an approximation based on the CLE. …”
    Journal article
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    ADM-CLE approach for detecting slow variables in continuous time Markov chains and dynamic data by Cucuringu, M, Erban, R

    Published 2017
    “…The resulting approach, called ADM-CLE, has the potential of being more efficient than the ADM method for a large class of chemical reaction systems, because it replaces the computationally most expensive step of ADM (running local short bursts of simulations) by using an approximation based on the CLE. …”
    Journal article
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    Comparative Study between ADMS and CFD in Modeling Dust Dispersion from a Blasting Events in Quarry by Wahyu Rinaldi, Teuku Mukhriza

    Published 2011-12-01
    “…Conventional Gaussian plume models developed by CERC, ADMS 3 and ADMS 4, were used to predict the pit retention. …”
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    Article
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    Development of rat duodenal monolayer model with effective barrier function from rat organoids for ADME assay by Kai Tanaka, Shigeto Kawai, Etsuko Fujii, Masumi Yano, Takashi Miyayama, Kiyotaka Nakano, Kimio Terao, Masami Suzuki

    Published 2023-07-01
    “…Abstract The in-depth analysis of the ADME profiles of drug candidates using in vitro models is essential for drug development since a drug’s exposure in humans depends on its ADME properties. …”
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    Improvements to the ADM1 based Process Simulation Model: Reaction segregation, parameter estimation and process optimization by Rami Bechara

    Published 2022-12-01
    “…This work presents a novel Aspen Plus ADM1-based flowsheet for this process. Three reactor segments were chosen: stoichiometric for the hydrolysis step, kinetic for acido-aceto-methanogenesis, and equilibrium for hydrogenotrophic methane production. …”
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