日期 影响因子
日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:
–

Investigation of the inhibitory potential of secondary metabolites isolated from Fernandoa adenophylla against Beta-glucuronidase via molecular docking and molecular dynamics simulation studies

通过分子对接和分子动力学模拟研究，探究从腺叶蕨中分离的次生代谢产物对β-葡糖醛酸酶的抑制潜力

期刊:PLoS One
影响因子:2.6
doi:10.1371/journal.pone.0324100
Rauf, Abdur; Ajaj, Rahaf; Akram, Zuneera; Khan, Majid; Wadood, Abdul; Zulfat, Maryam; Shah, Zafar Ali; Alamri, Abdulhakeem S; Alsanie, Walaa F; Alhomrani, Majid; Hussain, Humaira; Formanowicz, Dorota
代谢
发表日期：2025
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nach0: multimodal natural and chemical languages foundation model

nach0：多模态自然语言和化学语言基础模型

期刊:Chemical Science
影响因子:7.4
doi:10.1039/d4sc00966e
Livne, Micha; Miftahutdinov, Zulfat; Tutubalina, Elena; Kuznetsov, Maksim; Polykovskiy, Daniil; Brundyn, Annika; Jhunjhunwala, Aastha; Costa, Anthony; Aliper, Alex; Aspuru-Guzik, Alán; Zhavoronkov, Alex
发表日期：2024
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Identification of novel NLRP3 inhibitors as therapeutic options for epilepsy by machine learning-based virtual screening, molecular docking and biomolecular simulation studies

通过基于机器学习的虚拟筛选、分子对接和生物分子模拟研究，鉴定新型NLRP3抑制剂作为癫痫治疗方案

期刊:Heliyon
影响因子:3.6
doi:10.1016/j.heliyon.2024.e34410
Zulfat, Maryam; Hakami, Mohammed Ageeli; Hazazi, Ali; Mahmood, Arif; Khalid, Asaad; Alqurashi, Roaya S; Abdalla, Ashraf N; Hu, Junjian; Wadood, Abdul; Huang, Xiaoyun
NLRP3
LRP3
癫痫
神经科学
发表日期：2024
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In silico mutagenesis-based designing of oncogenic SHP2 peptide to inhibit cancer progression

利用计算机模拟诱变设计致癌性SHP2肽以抑制癌症进展

期刊:Scientific Reports
影响因子:3.9
doi:10.1038/s41598-023-37020-4
Shahab, Muhammad; Khan, Shahin Shah; Zulfat, Maryam; Bin Jardan, Yousef A; Mekonnen, Amare Bitew; Bourhia, Mohammed; Zheng, Guojun
肿瘤
肿瘤免疫
发表日期：2023
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