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Determining the properties of CaO-Al2O3-SiO2 slags from molecular dynamics simulation

• Authors : Zhu, Mengyi; Safarian, Jafar

Subjects: Slag; Properties; Structure

• Source: MOLTEN2024, 12th International Conference on Molten Slags, Fluxes and Salts, Brisbane, Australia, 17-19 June 2024

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Molecular Dynamics Simulation Study of Denaturation of Protein Under the Influence of Electric Field

• Authors : Deshmukh, S. P.; Kubade, K.S.; Ambekar, N.P.

Subjects: Physics; Ubiquitin; Protein Unfolding

• Source: International Journal of Science and Social Science Research, 1(2), 248-255, (2023-09-30)

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Molecular Dynamics Simulation Service

• Authors : Janet, Smith

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A versatile browser-based platform for molecular dynamics simulation and visualization

• Authors : Zhang, Yang; Zhang, Yang

Subjects: Computer-aided drug discovery; Molecular dynamics simulation; Drug discovery

• Source: EFMC-ISMC 2022, XXVll EFMC International Symposium on Medicinal Chemistry, Nice, France, September 4-8, 2022

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Explicative Molecular Dynamics Simulation Emphasizing Energy Transitions and Adsorption Thermodynamics: CH4 and Anthracite Sorbates

• Authors : North American Academic Researcher;

• Source: North American Academic Research, 7(8), (2024-08-26)

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In Silico Identification of Phytoconstituents from Capparis sepiaria as TNF-α and IL-1 Inhibitors for Rheumatoid Arthritis: Molecular Docking, ADMET Profiling, and Molecular Dynamics Simulation

• Authors : Martin, Darius Riziki

• Source: Journal of Chemical Information and Modeling, (2024-11-12)

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EXPLORING TARGET-BASED SCREENING, MOLECULAR DYNAMICS SIMULATION AND PRINCIPAL COMPONENT ANALYSIS FOR DRUG REPURPOSING IN NUT MIDLINE CARCINOMA

• Authors : Ajijur Rehman; Mihir Deshnehare; Goldi Tiwari

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Computational modelling, molecular docking, and molecular dynamics simulation studies of Enterococcus faecalis diaminopimelate epimerase

• Authors : Jyoti Chaudhary; Prashant Sharma; Nagendra Singh

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Integration of QSAR modeling and molecular dynamics simulation SIRT2 inhibitor as a candidate drug for inhibiting kidney damage

• Authors : Huang, Hung-Jin; Ho, Li-Ju; Su, Ruei-Yu

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Computational Analysis and Phytochemical Screening Targeting Dihydrolipoamide Dehydrogenase (DLD) for Alzheimer's Disease: A Molecular Dynamics Simulation Study

• Authors : Brescia, Valerio; Muhammad, Mazhar Fareed

• Source: European journal of volunteering and community-based projects, 1(2), 70-94, (2024-07-08)

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