Research Publications
|
Article Name |
Publication Type |
Journal Name |
ISSN No |
Volume |
Year |
URL |
DOI |
A Theoretical Model to Study the Interaction of Erythro-Noscapines with nsP3 protease of Chikungunya Virus
|
Research Papers in Scopus Listed Journals
|
Chemistry Select
|
|
4(17) |
2019 |
|
https://doi.org/10.1002/slct.201803360
|
Emergence of Infectious Diseases, Nanotechnology Aspects, Challenges, and
Future Perspectives.
|
Research Papers in Scopus Listed Journals
|
Chemistry Select
|
|
5(25): |
2020 |
|
https://doi.org/10.1002%2Fslct.202001709
|
Understanding the binding affinity of noscapines with protease of SARS-CoV-2 for COVID-19 using MD simulations at different temperatures
|
Research Papers in Scopus Listed Journals
|
J. Biomol. Struct. Dyn.
|
|
39(7) |
2021 |
|
https://doi.org/10.1080/07391102.2020.1752310
|
Promising inhibitors of main protease of novel corona virus to prevent the spread of COVID-19 using docking and molecular dynamics simulation
|
Research Papers in Scopus Listed Journals
|
J. Biomol. Struct. Dyn.
|
|
39(13) |
2021 |
|
https://doi.org/10.1080/07391102.2020.1779131
|
In-silico
prediction of novel drug-target complex of nsp3 of CHIKV through molecular dynamic
simulation.
|
Research Papers in Scopus Listed Journals
|
Heliyon
|
|
6(8) |
2020 |
|
https://doi.org/10.1016/j.heliyon.2020.e04720
|
Noscapine anticancer
drug designed with ionic liquids to enhance solubility: DFT and ADME approach. J. Mol.
Liq.
|
Research Papers in Peer Reviewed Journals
|
Journal of Molecular Liquids
|
|
volume 325 |
2021 |
|
https://doi.org/10.1016/j.molliq.2020.115159
|
Investigate the interaction of
testosterone/progesterone with ionic liquids on varying the anion to combat COVID-19:
Density functional theory calculations and molecular docking approach.
|
Research Papers in Scopus Listed Journals
|
J. Phys. Org. Chem.
|
|
34(12) |
2021 |
|
https://doi.org/10.1002/poc.4273
|
In Silico Evaluation of Binding of 2-Deoxy-D-Glucose with Mpro of nCoV to Combat COVID-19
|
Research Papers in Scopus Listed Journals
|
Pharmaceutics
|
|
14(1) |
2022 |
|
https://doi.org/10.3390/pharmaceutics14010135
|
A review on recent advancements on removal of harmful metal/metal ions using graphene oxide: Experimental and theoretical approaches
|
Research Papers in Scopus Listed Journals
|
Science of The Total Environment
|
1879-1026
|
858 |
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0048969722067729 |
https://doi.org/10.1016/j.scitotenv.2022.159672
|
An understanding of coronavirus and exploring the molecular dynamics simulations to find promising candidates against the Mpro of nCoV to combat the COVID-19: A systematic review
|
Research Papers in Scopus Listed Journals
|
Journal of Infection and Public Health
|
1876-035X
|
15 |
2023 |
https://www.sciencedirect.com/science/article/pii/S1876034122002702?via%3Dihub |
https://doi.org/10.1016/j.jiph.2022.10.013
|
Influence of cation (imidazolium based ionic liquids) as “smart” stabilizers for silver nanoparticles and their evaluation as antibacterial activity on Escherichia coli, Staphylococcus aureus and Enterobacter cloacae
|
Research Papers in Scopus Listed Journals
|
Journal of Molecular Liquids
|
1873-3166
|
369 |
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0167732222024746 |
https://doi.org/10.1016/j.molliq.2022.120935
|
Facile synthesis, antimicrobial screening and docking studies of pyrrole-triazole hybrids as potential antimicrobial agents
|
Research Papers in Scopus Listed Journals
|
Research on Chemical Intermediates
|
1568-5675
|
|
2023 |
https://link.springer.com/article/10.1007/s11164-022-04948-7 |
doi.org/10.1007/s11164-022-04948-7
|
Synthesis, Antimicrobial, Antibiofilm and Computational studies of Isatin-Semicarbazone Tethered 1,2,3-Triazoles
|
Research Papers in Scopus Listed Journals
|
Bioorganic Chemistry
|
1090-2120
|
|
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0045206823000482 |
10.1016/j.bioorg.2023.106388
|
Bioinspired green deep eutectic solvents: preparation, catalytic activity, and biocompatibility
|
Research Papers in Scopus Listed Journals
|
Journal of Molecular Liquids
|
1873-3166
|
|
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0167732223001587 |
https://doi.org/10.1016/j.molliq.2023.121355
|
A review on synthesis of antiviral drugs, in silico studies and their toxicity
|
Research Papers in Scopus Listed Journals
|
Journal of the Indian Chemical Society
|
2667-2847
|
|
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0019452223000596 |
https://doi.org/10.1016/j.jics.2023.100936
|
Synthesis, Antimicrobial, Antibiofilm and Computational studies of Isatin-Semicarbazone Tethered 1, 2, 3-Triazoles
|
Research Papers in Peer Reviewed Journals
|
Bioorganic Chemistry
|
1090-2120
|
133 |
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0045206823000482 |
https://doi.org/10.1016/j.bioorg.2023.106388
|
Facile synthesis, antimicrobial screening and docking studies of pyrrole-triazole hybrids as potential antimicrobial agents
|
Research Papers in Peer Reviewed Journals
|
Research on Chemical Intermediates
|
1568-5675
|
49 |
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0045206823000482 |
https://doi.org/10.1007/s11164-022-04948-7
|
Isatin-Semicarbazone Linked Acetamide 1,2,3-Triazole Hybrids: Synthesis, Antimicrobial Evaluation and Docking Simulations
|
Research Papers in Peer Reviewed Journals
|
Journal of Molecular Structure
|
1872-8014
|
1287 |
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0022286023007561 |
https://doi.org/10.1016/j.molstruc.2023.135660
|
Investigate the designing of eutectic mixture using DFT computation and evaluate their biological potency using molecular docking
|
Research Papers in Peer Reviewed Journals
|
Journal of Molecular Liquids
|
121723
|
381 |
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0167732223005263 |
https://doi.org/10.1016/j.molliq.2023.121723
|
An investigation to understand the correlation between the experimental and density functional theory calculations of noscapine
|
Research Papers in Peer Reviewed Journals
|
Journal of Physical Organic Chemistry
|
1099-1395
|
|
2023 |
https://onlinelibrary.wiley.com/doi/10.1002/poc.4502?af=R |
https://doi.org/10.1002/poc.4502
|
Influence of cation (imidazolium based ionic liquids) as “smart” stabilizers for silver nanoparticles and their evaluation as antibacterial activity on Escherichia coli, Staphylococcus aureus and Enterobacter cloacae
|
Research Papers in Peer Reviewed Journals
|
Journal of Molecular Liquids
|
1873-3166
|
369 |
2023 |
https://www.sciencedirect.com/science/article/abs/pii/S0167732222024746 |
https://doi.org/10.1016/j.molliq.2022.120935
|