• Users Online: 459
  • Home
  • Print this page
  • Email this page
Home About us Editorial board Ahead of print Current issue Search Archives Submit article Instructions Subscribe Contacts Login 

    Article Cited by others

RESEARCH ARTICLE

Computer-aided analysis of phytochemicals as potential dengue virus inhibitors based on molecular docking, ADMET and DFT studies

Qaddir Iqra, Rasool Nouman, Hussain Waqar, Mahmood Sajid

Year : 2017| Volume: 54| Issue : 3 | Page no: 255-262

   This article has been cited by
 
1 Berberis lyceum and Fumaria indica: in vitro cytotoxicity, antioxidant activity, and in silico screening of their selected phytochemicals as novel hepatitis C virus nonstructural protein 5A inhibitors
Koloko Brice Landry,Somayya Tariq,Ayesha Malik,Muhammad Sufyan,Usman Ali Ashfaq,Bushra Ijaz,Ahmad Ali Shahid
Journal of Biomolecular Structure and Dynamics. 2021; : 1
[Pubmed]  [Google Scholar] [DOI]
2 Recent insights on anti-dengue virus (DENV) medicinal plants: review on in vitro, in vivo and in silico discoveries
Sharoen Yu Ming Lim,Jin Yu Chieng,Yan Pan
All Life. 2021; 14(1): 1
[Pubmed]  [Google Scholar] [DOI]
3 Computational Studies of 3D-QSAR on a Highly Active Series of Naturally Occurring Nonnucleoside Inhibitors of HIV-1 RT (NNRTI)
Waqar Hussain,Arshia Majeed,Ammara Akhtar,Nouman Rasool
Journal of Computational Biophysics and Chemistry. 2021; 20(01): 3
[Pubmed]  [Google Scholar] [DOI]
4 Virtual Screening of Phytochemicals by Targeting HR1 Domain of SARS-CoV-2 S Protein: Molecular Docking, Molecular Dynamics Simulations, and DFT Studies
Arshia Majeed,Waqar Hussain,Farkhanda Yasmin,Ammara Akhtar,Nouman Rasool,R. K. Tripathy
BioMed Research International. 2021; 2021: 1
[Pubmed]  [Google Scholar] [DOI]
5 Phytochemicals from Selective Plants Have Promising Potential against SARS-CoV-2: Investigation and Corroboration through Molecular Docking, MD Simulations, and Quantum Computations
Kafila Kousar,Arshia Majeed,Farkhanda Yasmin,Waqar Hussain,Nouman Rasool,Antonello Merlino
BioMed Research International. 2020; 2020: 1
[Pubmed]  [Google Scholar] [DOI]
6 An in silico investigation of phytochemicals as potential inhibitors against non-structural protein 1 from dengue virus 4
Iqra Qaddir,Arshia Majeed,Waqar Hussain,Sajid Mahmood,Nouman Rasool
Brazilian Journal of Pharmaceutical Sciences. 2020; 56
[Pubmed]  [Google Scholar] [DOI]
7 Computer-aided Analysis of Selective Phytochemicals as Potent Inhibitors of Parkin: Major Biological Target of Parkinson’s disease
Arif Nadia,Subhani Andleeb,Hussain Waqar,Rasool Nouman
Global Journal of Biotechnology and Biomaterial Science. 2020; 6(1): 013
[Pubmed]  [Google Scholar] [DOI]
8 Latest Updates in Dengue Fever Therapeutics: Natural, Marine and Synthetic Drugs
Samira Hosseini,Rodrigo B. Muñoz-Soto,Jacqueline Oliva-Ramírez,Patricia Vázquez-Villegas,Nasrin Aghamohammadi,Aida Rodriguez-Garcia,Sergio O. Martinez-Chapa
Current Medicinal Chemistry. 2020; 27(5): 719
[Pubmed]  [Google Scholar] [DOI]
9 A Sequence-Based Predictor of Zika Virus Proteins Developed by Integration of PseAAC and Statistical Moments
Waqar Hussain,Nouman Rasool,Yaser D. Khan
Combinatorial Chemistry & High Throughput Screening. 2020; 23(8): 797
[Pubmed]  [Google Scholar] [DOI]
10 Antiviral effect of silymarin against Zika virus in vitro
Tales Fernando da Silva,Ariane Coelho Ferraz,Letícia Trindade Almeida,Camila Carla da Silva Caetano,Fernanda Caetano Camini,Rafaela Lameira Souza Lima,Ana Cláudia dos Santos Pereira Andrade,Danilo Bretas de Oliveira,Kamila Lorene Soares Rocha,Breno de Mello Silva,José Carlos de Magalhães,Cintia Lopes de Brito Magalhães
Acta Tropica. 2020; 211: 105613
[Pubmed]  [Google Scholar] [DOI]
11 Computer-aided study of selective flavonoids against chikungunya virus replication using molecular docking and DFT-based approach
Waqar Hussain,Anam Amir,Nouman Rasool
Structural Chemistry. 2020;
[Pubmed]  [Google Scholar] [DOI]
12 Insights into the inhibitory potential of selective phytochemicals against Mpro of 2019-nCoV: a computer-aided study
Nouman Rasool,Ammara Akhtar,Waqar Hussain
Structural Chemistry. 2020;
[Pubmed]  [Google Scholar] [DOI]
13 Identification of novel inhibitory candidates against two major Flavivirus pathogens via CADD protocols: in silico analysis of phytochemical binding, reactivity, and pharmacokinetics against NS5 from ZIKV and DENV
Nouman Rasool,Arshia Majeed,Fareeha Riaz,Waqar Hussain
Structural Chemistry. 2020;
[Pubmed]  [Google Scholar] [DOI]
14 Network-Pharmacology and DFT Based Approach Towards Identification of Leads from Homalomena aromatica for Multi-Target In-Silico Screening on Entamoeba histolytica Proteins
Ashis Kumar Goswami,Hemanta Kumar Sharma,Neelutpal Gogoi,Bhaskar Jyoti Gogoi
Current Drug Therapy. 2020; 15(3): 226
[Pubmed]  [Google Scholar] [DOI]
15 in silico discovery of potential inhibitors against Dipeptidyl Peptidase-4: A major biological target of Type-2 diabetes mellitus
Subhani Andleeb,Arif Nadia,Hussain Waqar,Rasool Nouman
International Journal of Clinical Microbiology and Biochemical Technology. 2020; 3(1): 001
[Pubmed]  [Google Scholar] [DOI]
16 Flavonoids as Antiviral Agents for Enterovirus A71 (EV-A71)
Salima Lalani,Chit Laa Poh
Viruses. 2020; 12(2): 184
[Pubmed]  [Google Scholar] [DOI]
17 Antiviral Activities of Silymarin and Derivatives
Ching-Hsuan Liu,Alagie Jassey,Hsin-Ya Hsu,Liang-Tzung Lin
Molecules. 2019; 24(8): 1552
[Pubmed]  [Google Scholar] [DOI]
18 In Silico and In Vitro Anti-Helicobacter Pylori Effects of Combinations of Phytochemicals and Antibiotics
Pedro Fong,Chon-Hou Hao,Chi-Cheng Io,Pou-Io Sin,Li-Rong Meng
Molecules. 2019; 24(19): 3608
[Pubmed]  [Google Scholar] [DOI]
19 iProtease-PseAAC(2L): A two-layer predictor for identifying proteases and their types using Chouæs 5-step-rule and general PseAAC
Yaser Daanial Khan,Najm Amin,Waqar Hussain,Nouman Rasool,Sher Afzal Khan,Kuo-Chen Chou
Analytical Biochemistry. 2019; : 113477
[Pubmed]  [Google Scholar] [DOI]
20 Probing the Pharmacological Binding Properties, and Reactivity of Selective Phytochemicals as Potential HIV-1 protease Inhibitors
Ammara Akhtar,Waqar Hussain,Nouman Rasool
Universitas Scientiarum. 2019; 24(3): 441
[Pubmed]  [Google Scholar] [DOI]
21 A Multi-Perspective Review on Dengue Research
M. Elizabeth Sobhia,Ketan Ghosh,Ajeet Singh,Komal Sul,Monica Singh,Ravi Kumar,Ravi Sandeep,Satti Merugu,Sunilchand Donempudi
Current Drug Targets. 2019; 20(15): 1550
[Pubmed]  [Google Scholar] [DOI]
22 Potential of medicinal plants to treat dengue
Dulanjalee Neelawala,Sanjaya Rajapakse,Wikum Widuranga Kumbukgolla
International Journal of One Health. 2019; : 86
[Pubmed]  [Google Scholar] [DOI]
23 Probing the Pharmacological Parameters, Molecular Docking and Quantum Computations of Plant Derived Compounds Exhibiting Strong Inhibitory Potential Against NS5 from Zika Virus
Nouman Rasool,Amir Jalal,Adnan Amjad,Waqar Hussain
Brazilian Archives of Biology and Technology. 2018; 61(0)
[Pubmed]  [Google Scholar] [DOI]
24 In silico targeting of non-structural 4B protein from dengue virus 4 with spiropyrazolopyridone: study of molecular dynamics simulation, ADMET and virtual screening
Waqar Hussain,Iqra Qaddir,Sajid Mahmood,Nouman Rasool
VirusDisease. 2018;
[Pubmed]  [Google Scholar] [DOI]

 

Read this article