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

Unlocking the antimalarial potential of novel steroid-tetraoxane hybrids through consensus molecular docking and molecular dynamics investigation

通过共识分子对接和分子动力学研究揭示新型甾体-四氧烷杂合物的抗疟潜力

期刊:Scientific Reports
影响因子:3.9
doi:10.1038/s41598-025-13017-z
Nath, Dipankar; Debnath, Abhijit; Sarma, Malita; Singh, Rajesh Kumar; Chetia, Dipak
发表日期：2025
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Identification of bioactive molecules from Triphala (Ayurvedic herbal formulation) as potential inhibitors of SARS-CoV-2 main protease (Mpro) through computational investigations.

通过计算研究鉴定三果宝（阿育吠陀草药配方）中的生物活性分子作为 SARS-CoV-2 主蛋白酶 (Mpro) 的潜在抑制剂

期刊:Journal of King Saud University Science
影响因子:3.6
doi:10.1016/j.jksus.2022.101826
Rudrapal Mithun, Celik Ismail, Khan Johra, Ansari Mohammad Azam, Alomary Mohammad N, Yadav Rohitash, Sharma Tripti, Tallei Trina Ekawati, Pasala Praveen Kumar, Sahoo Ranjan Kumar, Khairnar Shubham J, Bendale Atul R, Zothantluanga James H, Chetia Dipak, Walode Sanjay G
免疫/内分泌
新冠
发表日期：2022
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Integrated computational approach towards repurposing of antimalarial drug against SARS-CoV-2 main protease

利用综合计算方法重新利用抗疟疾药物对抗SARS-CoV-2主蛋白酶

期刊:Structural Chemistry
影响因子:2.2
doi:10.1007/s11224-022-01916-0
Gogoi, Neelutpal; Chowdhury, Purvita; Goswami, Ashis Kumar; Das, Aparoop; Chetia, Dipak; Gogoi, Bhaskarjyoti
SARS-CoV-2
微生物学
疟疾
发表日期：2022
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Antiviral phytocompounds "ellagic acid" and "(+)-sesamin" of Bridelia retusa identified as potential inhibitors of SARS-CoV-2 3CL pro using extensive molecular docking, molecular dynamics simulation studies, binding free energy calculations, and bioactivity prediction

利用广泛的分子对接、分子动力学模拟研究、结合自由能计算和生物活性预测，鉴定出布里德利亚树（Bridelia retusa）中的抗病毒植物化合物“鞣花酸”和“(+)-芝麻素”是SARS-CoV-2 3CLpro的潜在抑制剂。

期刊:Structural Chemistry
影响因子:2.2
doi:10.1007/s11224-022-01959-3
Umar, Abd Kakhar; Zothantluanga, James H; Aswin, Keerthic; Maulana, Saipul; Sulaiman Zubair, Muhammad; Lalhlenmawia, H; Rudrapal, Mithun; Chetia, Dipak
微生物学
SARS-CoV-2
发表日期：2022
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Repurposing of phytomedicine-derived bioactive compounds with promising anti-SARS-CoV-2 potential: Molecular docking, MD simulation and drug-likeness/ADMET studies

植物药源生物活性化合物的再利用及其对SARS-CoV-2的潜在疗效：分子对接、分子动力学模拟和类药性/ADMET研究

期刊:Saudi Journal of Biological Sciences
影响因子:
doi:10.1016/j.sjbs.2021.12.018
Rudrapal, Mithun; Gogoi, Neelutpal; Chetia, Dipak; Khan, Johra; Banwas, Saeed; Alshehri, Bader; Alaidarous, Mohammed A; Laddha, Umesh D; Khairnar, Shubham J; Walode, Sanjay G
SARS-CoV-2
MET
发表日期：2022
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Design, molecular docking, drug-likeness, and molecular dynamics studies of 1,2,4-trioxane derivatives as novel Plasmodium falciparum falcipain-2 (FP-2) inhibitors

1,2,4-三氧杂环己烷衍生物作为新型恶性疟原虫恶性疟原虫蛋白酶-2 (FP-2) 抑制剂的设计、分子对接、类药性和分子动力学研究

期刊:
影响因子:
doi:10.5114/bta.2021.108722
Ghosh, Subham; Chetia, Dipak; Gogoi, Neelutpal; Rudrapal, Mithun
发表日期：2021
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Endoperoxide antimalarials: development, structural diversity and pharmacodynamic aspects with reference to 1,2,4-trioxane-based structural scaffold

内过氧化物抗疟药：基于1,2,4-三氧杂环己烷结构骨架的开发、结构多样性和药效学方面

期刊:Drug Design Development and Therapy
影响因子:5.1
doi:10.2147/DDDT.S118116
Rudrapal, Mithun; Chetia, Dipak
发表日期：2016
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