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Open defecation and childhood stunting in India: an ecological analysis of new data from 112 districts

PloS one, 2013-09, Vol.8 (9), p.e73784

2013

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Molecular Docking, Validation, Dynamics Simulations, and Pharmacokinetic Prediction of Phytochemicals Isolated From Croton dichogamus Against the HIV-1 Reverse Transcriptase

Bioinformatics and biology insights, 2022-01, Vol.16, p.117793222211256-11779322221125605

2022

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Modelling the DFT structural and reactivity study of feverfew and evaluation of its potential antiviral activity against COVID-19 using molecular docking and MD simulations

Chemical papers, 2022, Vol.76 (5), p.2759-2776

2022

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Towards designing of a potential new HIV-1 protease inhibitor using QSAR study in combination with Molecular docking and Molecular dynamics simulations

PloS one, 2023-04, Vol.18 (4), p.e0284539-e0284539

2023

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AlphaFold2 modeling and molecular dynamics simulations of an intrinsically disordered protein

PloS one, 2024-05, Vol.19 (5), p.e0301866-e0301866

2024

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Synergistic inhibition of glioblastoma multiforme through an in-silico analysis of luteolin and ferulic acid derived from Angelica sinensis and Cannabis sativa: Advancements in computational therapeutics

PloS one, 2023-11, Vol.18 (11), p.e0293666-e0293666

2023

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Dynamics of natural product Lupenone as a potential fusion inhibitor against the spike complex of novel Semliki Forest Virus

PloS one, 2022-02, Vol.17 (2), p.e0263853-e0263853

2022

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Application of in-silico drug discovery techniques to discover a novel hit for target-specific inhibition of SARS-CoV-2 Mpro's revealed allosteric binding with MAO-B receptor: A theoretical study to find a cure for post-covid neurological disorder

PloS one, 2024-01, Vol.19 (1), p.e0286848-e0286848

2024

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Screening fructosamine-3-kinase (FN3K) inhibitors, a deglycating enzyme of oncogenic Nrf2: Human FN3K homology modelling, docking and molecular dynamics simulations

PloS one, 2023-11, Vol.18 (11), p.e0283705-e0283705

2023

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Albendazole repurposing on VEGFR-2 for possible anticancer application: In-silico analysis

PloS one, 2023-08, Vol.18 (8), p.e0287198-e0287198

2023

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Impact of CAR-T cell therapy on treating viral infections: unlocking the door to recovery

Human cell : official journal of Human Cell Research Society, 2023-09, Vol.36 (5), p.1839-1842

2023

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Lupenone, a wonder chemical obtained from Euphorbia segetalis to boost affinity for the transcriptional factor escalating drought-tolerance in Solanum Lycopersicum: A cutting-edge computational biology approach

PloS one, 2023-11, Vol.18 (11), p.e0281293-e0281293

2023

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Different aspects in explaining how mutations could affect the binding mechanism of receptor binding domain of SARS-CoV-2 spike protein in interaction with ACE2

PloS one, 2023-09, Vol.18 (9), p.e0291210-e0291210

2023

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Structure-activity relationship (SAR) and molecular dynamics study of withaferin-A fragment derivatives as potential therapeutic lead against main protease (Mpro) of SARS-CoV-2

Journal of molecular modeling, 2021-02, Vol.27 (3), p.97-97, Article 97

2021

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Mitochondrial genome in sporadic breast cancer: A case control study and a proteomic analysis in a Sinhalese cohort from Sri Lanka

PloS one, 2023-02, Vol.18 (2), p.e0281620-e0281620

2023

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Nonlinear molecular dynamics of quercetin in Gynocardia odorata and Diospyros malabarica fruits: Its mechanistic role in hepatoprotection

PloS one, 2022-03, Vol.17 (3), p.e0263917-e0263917

2022

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In silico investigation of phytoconstituents of medicinal herb ‘Piper Longum’ against SARS-CoV-2 by molecular docking and molecular dynamics analysis

Results in Chemistry, 2021-01, Vol.3, p.100199-100199, Article 100199

2021

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Identification of some bioactive compounds from Trignonella foenumgraecum as possible inhibitors of PPARϒ for diabetes treatment through molecular docking studies, pharmacophore modelling and ADMET profiling: An in-silico study

PloS one, 2023, Vol.18 (5), p.e0284210-e0284210

2023

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Virtual 2D map of cyanobacterial proteomes

PloS one, 2022-10, Vol.17 (10), p.e0275148-e0275148

2022

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Macrolactin A as a Novel Inhibitory Agent for SARS-CoV-2 Mpro: Bioinformatics Approach

Applied biochemistry and biotechnology, 2021-10, Vol.193 (10), p.3371-3394

2021

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Propolis of stingless bees for the development of novel functional food and nutraceutical ingredients: A systematic scoping review of the experimental evidence

Journal of functional foods, 2022-01, Vol.88, p.104902, Article 104902

2022

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Photovoltaic module performance: Modeling, parameter estimation, and environmental effects

e-Prime, 2024-06, Vol.8, p.100529, Article 100529

2024

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Technology of Polymer Packaging

Ghosh, Arabinda

1, 2015

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Neoechinulins: Molecular, cellular, and functional attributes as promising therapeutics against cancer and other human diseases

Biomedicine & pharmacotherapy, 2022-01, Vol.145, p.112378-112378, Article 112378

2022

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Open defecation and childhood stunting in India: an ecological analysis of new data from 112 districts

Molecular Docking, Validation, Dynamics Simulations, and Pharmacokinetic Prediction of Phytochemicals Isolated From Croton dichogamus Against the HIV-1 Reverse Transcriptase

Modelling the DFT structural and reactivity study of feverfew and evaluation of its potential antiviral activity against COVID-19 using molecular docking and MD simulations

Towards designing of a potential new HIV-1 protease inhibitor using QSAR study in combination with Molecular docking and Molecular dynamics simulations

AlphaFold2 modeling and molecular dynamics simulations of an intrinsically disordered protein

Synergistic inhibition of glioblastoma multiforme through an in-silico analysis of luteolin and ferulic acid derived from Angelica sinensis and Cannabis sativa: Advancements in computational therapeutics

Dynamics of natural product Lupenone as a potential fusion inhibitor against the spike complex of novel Semliki Forest Virus

Application of in-silico drug discovery techniques to discover a novel hit for target-specific inhibition of SARS-CoV-2 Mpro's revealed allosteric binding with MAO-B receptor: A theoretical study to find a cure for post-covid neurological disorder

Screening fructosamine-3-kinase (FN3K) inhibitors, a deglycating enzyme of oncogenic Nrf2: Human FN3K homology modelling, docking and molecular dynamics simulations

Albendazole repurposing on VEGFR-2 for possible anticancer application: In-silico analysis

Impact of CAR-T cell therapy on treating viral infections: unlocking the door to recovery

Lupenone, a wonder chemical obtained from Euphorbia segetalis to boost affinity for the transcriptional factor escalating drought-tolerance in Solanum Lycopersicum: A cutting-edge computational biology approach

Different aspects in explaining how mutations could affect the binding mechanism of receptor binding domain of SARS-CoV-2 spike protein in interaction with ACE2

Structure-activity relationship (SAR) and molecular dynamics study of withaferin-A fragment derivatives as potential therapeutic lead against main protease (Mpro) of SARS-CoV-2

Wheat ergot fungus-derived and modified drug for inhibition of intracranial aneurysm rupture due to dysfunction of TLR-4 receptor in Alzheimer's disease

Mitochondrial genome in sporadic breast cancer: A case control study and a proteomic analysis in a Sinhalese cohort from Sri Lanka

Nonlinear molecular dynamics of quercetin in Gynocardia odorata and Diospyros malabarica fruits: Its mechanistic role in hepatoprotection

In silico investigation of phytoconstituents of medicinal herb ‘Piper Longum’ against SARS-CoV-2 by molecular docking and molecular dynamics analysis

Identification of some bioactive compounds from Trignonella foenumgraecum as possible inhibitors of PPARϒ for diabetes treatment through molecular docking studies, pharmacophore modelling and ADMET profiling: An in-silico study

Virtual 2D map of cyanobacterial proteomes

Macrolactin A as a Novel Inhibitory Agent for SARS-CoV-2 Mpro: Bioinformatics Approach

Propolis of stingless bees for the development of novel functional food and nutraceutical ingredients: A systematic scoping review of the experimental evidence

Photovoltaic module performance: Modeling, parameter estimation, and environmental effects

Technology of Polymer Packaging

Neoechinulins: Molecular, cellular, and functional attributes as promising therapeutics against cancer and other human diseases

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