Probing marine brown macroalgal phlorotannins as antiviral candidate against SARS-CoV-2: molecular docking and dynamics simulation approach

被引：0
|
作者：
Sathaiah Gunaseelan
Malaisamy Arunkumar
Manikka Kubendran Aravind
Santhalingam Gayathri
Senthil Rajkeerthana
Verma Mohankumar
Balasubramaniem Ashokkumar
Perumal Varalakshmi
机构：
[1] Madurai Kamaraj University,Department of Molecular Microbiology, School of Biotechnology
[2] Madurai Kamaraj University,Department of Genetic Engineering, School of Biotechnology
[3] International Centre for Genetic Engineering and Biotechnology (ICGEB),Transcription Regulation Group
来源：
Molecular Diversity | 2022年 / 26卷
关键词：
Phlorotannin; Antiviral; Polyphenol; SARS-CoV-2; COVID-19; Molecular docking and dynamics simulation;
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
页码：3205 / 3224
页数：19
相关论文
共 50 条
  • [1] Probing marine brown macroalgal phlorotannins as antiviral candidate against SARS-CoV-2: molecular docking and dynamics simulation approach
    Gunaseelan, Sathaiah
    Arunkumar, Malaisamy
    Aravind, Manikka Kubendran
    Gayathri, Santhalingam
    Rajkeerthana, Senthil
    Mohankumar, Verma
    Ashokkumar, Balasubramaniem
    Varalakshmi, Perumal
    [J]. MOLECULAR DIVERSITY, 2022, 26 (06) : 3205 - 3224
  • [2] In Silico Identification and Analysis of Potentially Bioactive Antiviral Phytochemicals against SARS-CoV-2: A Molecular Docking and Dynamics Simulation Approach
    Halder, Sajal Kumar
    Sultana, Ive
    Shuvo, Md Nazmussakib
    Shil, Aparna
    Himel, Mahbubul Kabir
    Hasan, Md. Ashraful
    Shawan, Mohammad Mahfuz Ali Khan
    [J]. BIOMED RESEARCH INTERNATIONAL, 2023, 2023
  • [3] Investigating the potential antiviral activity drugs against SARS-CoV-2 by molecular docking simulation
    El-hoshoudy, A. N.
    [J]. JOURNAL OF MOLECULAR LIQUIDS, 2020, 318
  • [4] Antiviral peptides against the main protease of SARS-CoV-2: A molecular docking and dynamics study
    Mahmud, Shafi
    Biswas, Suvro
    Paul, Gobindo Kumar
    Mita, Mohasana Akter
    Afrose, Shamima
    Hasan, Md Robiul
    Shimu, Mst Sharmin Sultana
    Uddin, Mohammad Abu Raihan
    Uddin, Md Salah
    Zaman, Shahriar
    Kibria, K. M. Kaderi
    Khan, Md Arif
    Bin Emran, Talha
    Abu Saleh, Md
    [J]. ARABIAN JOURNAL OF CHEMISTRY, 2021, 14 (09)
  • [5] Arjunetin as a promising drug candidate against SARS-CoV-2: molecular dynamics simulation studies
    Arumugam, Gandarvakottai Senthilkumar
    Sen, Asmita
    Dash, Swati S.
    Mitra, Kartik
    Doble, Mukesh
    Rajaraman, Gopalan
    Gummadi, Sathyanarayana N.
    [J]. JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2022, 40 (22): : 12358 - 12379
  • [6] Molecular Docking and Dynamics Simulation of Several Flavonoids Predict Cyanidin as an Effective Drug Candidate against SARS-CoV-2 Spike Protein
    Shrestha, Asmita
    Marahatha, Rishab
    Basnet, Saroj
    Regmi, Bishnu P.
    Katuwal, Saurav
    Dahal, Salik Ram
    Sharma, Khaga Raj
    Adhikari, Achyut
    Chandra Basnyat, Ram
    Parajuli, Niranjan
    [J]. ADVANCES IN PHARMACOLOGICAL AND PHARMACEUTICAL SCIENCES, 2022, 2022
  • [7] The potential role of procyanidin as a therapeutic agent against SARS-CoV-2: a text mining, molecular docking and molecular dynamics simulation approach
    Maroli, Nikhil
    Bhasuran, Balu
    Natarajan, Jeyakumar
    Kolandaivel, Ponmalai
    [J]. JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2022, 40 (03): : 1230 - 1245
  • [8] Molecular Docking against SARS-CoV-2 Variants, Antiviral Effects, Dynamics and Quantum Chemical Modeling of Mannopyranoside Derivatives
    Kawsar, Sarkar M. A.
    Ferdous, Jannatul
    Hossain, Mohammed K.
    Kumer, Ajoy
    Akash, Shopnil
    Chakma, Unesco
    [J]. MOROCCAN JOURNAL OF CHEMISTRY, 2023, 11 (04): : 1266 - 1286
  • [9] Combined docking methods and molecular dynamics to identify effective antiviral 2, 5-diaminobenzophenonederivatives against SARS-CoV-2
    Ouassaf, Mebarka
    Belaidi, Salah
    Al Mogren, Muneerah Mogren
    Chtita, Samir
    Khan, Shafi Ullah
    Htar, Thet Thet
    [J]. JOURNAL OF KING SAUD UNIVERSITY SCIENCE, 2021, 33 (02)
  • [10] Molecular docking and dynamics simulation of main protease of SARS-CoV-2 with naproxen derivative
    Hussein, Rageh K.
    Marashdeh, Mohammad
    El-Khayatt, Ahmed M.
    [J]. BIOINFORMATION, 2023, 19 (04) : 358 - 361
12345