نتائج البحث

Network pharmacology and molecular dynamics simulation reveal antineoplastic potential of Antarctic sponge-derived suberitenones.

• Authors : Bhowmik, Prasenjit; Mallick, Rahul; Duttaroy, Asim K.

Subjects: MARINE natural products; MOLECULAR dynamics; MOLECULAR docking

• Source: Frontiers in Chemistry; 2025, p1-24, 24p

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Exploring the therapeutic mechanism of curcumin in spinal cord injury treatment based on network pharmacology, molecular dynamics simulation, and experimental validation.

• Authors : He, Yongzhi; Lu, Jiachun; Luo, Yushan

• Source: Frontiers in Chemistry; 2025, p1-15, 15p

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Mechanism of Strain-Resistance Response of CNT/Polymer Composite Materials for Pavement Strain Self-Sensing Based on the Molecular Dynamics Simulation Method.

• Authors : Xin, Xue; Zhao, Xingchi; Gao, Jing

Subjects: NANOCOMPOSITE materials; MOLECULAR dynamics; EPOXY resins

• Source: Polymers (20734360); Jun2025, Vol. 17 Issue 11, p1427, 24p

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含孔洞 CoCrNiFeCu 高熵合金纳米压入的分子动力学模拟.

• Authors : 史银花; 施琴

• Source: Journal of Atomic & Molecular Physics (1000-0364); Jun2025, Vol. 42 Issue 3, p1-8, 8p

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热塑性纤维素与 PVA 混溶性的分子动力学模拟.

• Authors : 冯彦洪; 陈帅杰; 孙航

• Source: Journal of Atomic & Molecular Physics (1000-0364); Jun2025, Vol. 42 Issue 3, p1-10, 10p

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Stability Analysis of Polymer Flooding-Produced Liquid in Oilfields Based on Molecular Dynamics Simulation.

• Authors : Huang, Qian; Shen, Mingming; Mu, Lingyan

Subjects: RADIAL distribution function; INTERFACIAL tension; POLYMER flooding (Petroleum engineering)

• Source: Materials (1996-1944); May2025, Vol. 18 Issue 10, p2349, 21p

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Alendronate repositioning as potential anti-parasitic agent targeting Trichinella spiralis inorganic pyrophosphatase, in vitro supported molecular docking and molecular dynamics simulation study.

• Authors : Hanafy, Marmar A.; Nassar, Doaa A.; Zahran, Fatima M.

Subjects: TRICHINELLA spiralis; MOLECULAR dynamics; MOLECULAR docking

• Source: BMC Chemistry; 5/6/2025, Vol. 19 Issue 1, p1-25, 25p

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Exploring the therapeutic mechanism of curcumin in spinal cord injury treatment based on network pharmacology, molecular dynamics simulation, and experimental validation.

• Authors : He, Yongzhi; Lu, Jiachun; Luo, Yushan

Subjects: MOLECULAR dynamics; TUMOR necrosis factors; SPINAL cord injuries

• Source: Frontiers in Chemistry; 2025, p1-15, 15p

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Exploring the therapeutic mechanism of curcumin in spinal cord injury treatment based on network pharmacology, molecular dynamics simulation, and experimental validation.

• Authors : He, Yongzhi; Lu, Jiachun; Luo, Yushan

Subjects: MOLECULAR dynamics; TUMOR necrosis factors; SPINAL cord injuries

• Source: Frontiers in Chemistry; 2025, p1-15, 15p

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Study on the Influence of Reservoir Wettability on Shale oil Flow Characteristics by Molecular Dynamics Simulation.

• Authors : Deng, Xingliang; Li, Shiyin; Guan, Baozhu

Subjects: SHALE oils; PHYSICAL & theoretical chemistry; MOLECULAR dynamics

• Source: Arabian Journal for Science & Engineering (Springer Science & Business Media B.V. ); Apr2025, Vol. 50 Issue 7, p4643-4660, 18p

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