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Publisher : keai communications co.

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Academic Journal

Applications of molecular dynamics simulation in studying shale oil reservoirs at the nanoscale: Advances, challenges and perspectives.

Authors : Lu Wang¹; Yi-Fan Zhang¹ ; Run Zou¹

Source: Petroleum Science (KeAi Communications Co.). Jan2025, Vol. 22 Issue 1, p234-254. 21p.

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Academic Journal

Probing the interaction between asphaltene-wax and its effects on the crystallization behavior of waxes in heavy oil via molecular dynamics simulation.

Authors : Yong Hu¹; Xi Lu¹; Hai-Bo Wang¹

Source: Petroleum Science (KeAi Communications Co.). Aug2024, Vol. 21 Issue 4, p2839-2848. 10p.

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Academic Journal

New insights into the deposition of natural gas hydrate on pipeline surfaces: A molecular dynamics simulation study.

Authors : Jun Zhang¹ ; Hai-Qiang Fu¹; Mu-Zhi Guo¹

Source: Petroleum Science (KeAi Communications Co.). Feb2024, Vol. 21 Issue 1, p694-704. 11p.

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Academic Journal

Comparison of the binding energies of approved mpox drugs and phytochemicals through molecular docking, molecular dynamics simulation, and ADMET studies: An in silico approach.

Authors : Mohapatra, Ranjan K.¹ ; Mahal, Ahmed²; Ansari, Azaj³

Source: Journal of Biosafety & Biosecurity. Sep2023, Vol. 5 Issue 3, p118-132. 15p.

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Academic Journal

Multi-target inhibition property of Persicaria hydropiper phytochemicals against gram-positive and gram-negative bacteria via molecular docking, dynamics simulation, and ADMET analysis.

Authors : Majumdar, Golak¹; Mandal, Shyamapada¹

Source: Digital Chinese Medicine. Mar2025, Vol. 8 Issue 1, p76-89. 14p.

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Academic Journal

Experimental and molecular dynamics evaluation of the effect of a sulfate surfactant on the shale's methane sorption.

Authors : Sharifigaliuk, Hamid¹ ; Vahid Khosravi²; Mansoor Zoveidavianpoor³

Source: Journal of Natural Gas Geoscience (2543-151X). Feb2025, Vol. 10 Issue 1, p59-74. 16p.

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Academic Journal

Soil conditioning of clay based on interface adhesion mechanism: Microscopic simulation and laboratory experiment.

Authors : Yong Fang¹ ; Bin Zhuo¹ ; Ruyue Zhang¹

Source: Underground Space (2096-2754). Oct2024, Vol. 18, p239-255. 17p.

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Academic Journal

Integrating immunoinformatics and computational epitope prediction for a vaccine candidate against respiratory syncytial virus.

Authors : Nguyen, Truc Ly¹; Kim, Heebal^1,2,3

Source: Infectious Disease Modelling (2468-2152). Sep2024, Vol. 9 Issue 3, p763-774. 12p.

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Academic Journal

Discovering peptides and computational investigations of a multiepitope vaccine target Mycobacterium tuberculosis.

Authors : Truc Ly Nguyen¹; Heebal Kim^1,2,3

Source: Synthetic & Systems Biotechnology. Sep2024, Vol. 9 Issue 3, p391-405. 15p.

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Academic Journal

Molecular insights into oil detachment from hydrophobic quartz surfaces in clay-hosted nanopores during steamesurfactant coinjection.

Authors : Ben-Jie-Ming Liu¹ ; Xuan-Tong Lei¹ ; Ahmadi, Mohammadali¹

Source: Petroleum Science (KeAi Communications Co.). Aug2024, Vol. 21 Issue 4, p2457-2468. 12p.

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نتائج البحث

فلترة النتائج

Applications of molecular dynamics simulation in studying shale oil reservoirs at the nanoscale: Advances, challenges and perspectives.

Probing the interaction between asphaltene-wax and its effects on the crystallization behavior of waxes in heavy oil via molecular dynamics simulation.

New insights into the deposition of natural gas hydrate on pipeline surfaces: A molecular dynamics simulation study.

Comparison of the binding energies of approved mpox drugs and phytochemicals through molecular docking, molecular dynamics simulation, and ADMET studies: An in silico approach.

Multi-target inhibition property of Persicaria hydropiper phytochemicals against gram-positive and gram-negative bacteria via molecular docking, dynamics simulation, and ADMET analysis.

Experimental and molecular dynamics evaluation of the effect of a sulfate surfactant on the shale's methane sorption.

Soil conditioning of clay based on interface adhesion mechanism: Microscopic simulation and laboratory experiment.

Integrating immunoinformatics and computational epitope prediction for a vaccine candidate against respiratory syncytial virus.

Discovering peptides and computational investigations of a multiepitope vaccine target Mycobacterium tuberculosis.

Molecular insights into oil detachment from hydrophobic quartz surfaces in clay-hosted nanopores during steamesurfactant coinjection.

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