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In silico approach to design new Cyclooxygenase-2 (COX-2) inhibitors based on MM/QM and ADMET analysis 基于 MM/QM 和 ADMET 分析设计新型环氧化酶-2 (COX-2) 抑制剂的硅学方法
Chemical Physics Impact Pub Date : 2024-02-01 DOI: 10.1016/j.chphi.2024.100509
Ashutosh Kharwar, Akanksha Mishra, Vijay Kumar Singh, A. Tiwari
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引用次数: 0
Investigation of Elastic Scattering Cross-Sections of Electron with Neon Atoms 电子与氖原子的弹性散射截面研究
Chemical Physics Impact Pub Date : 2024-01-01 DOI: 10.1016/j.chphi.2024.100503
Sanjeev Kumar, K. Kumar, Deepti Jain, Manveer Singh
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引用次数: 0
Novel scaffolds identification against Mpro of SARS-CoV-2 using shape based screening and molecular simulation methods 利用形状筛选和分子模拟方法鉴定抗 SARS-CoV-2 Mpro 的新型支架
Chemical Physics Impact Pub Date : 2024-01-01 DOI: 10.1016/j.chphi.2024.100496
Pawan Gupta, Umesh Panwar, S. Singh
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引用次数: 0
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