| 1 |
2024-01-04 |
Understanding the role of symmetric/asymmetric curcuminoids in designing efficient optical, nonlinear optical and photovoltaic materials |
Authors |
Optical and Quantum Electronics, () |
|
3.00 |
0306-8919 |
0306-8919 |
https://doi.org/10.1007/s11082-024-06298-7 |
https://link.springer.com/article/10.1007/s11082-024-06298-7 |
W |
| 2 |
2024-01-04 |
Computational prediction for designing novel ketonic derivatives as potential inhibitors for breast cancer: A trade-off between drug likeness and inhibition potency |
Authors |
Computational Biology and Chemistry, 109 (X) |
108020 |
3.10 |
1476-928X |
1476-9271 |
https://doi.org/10.1016/j.compbiolchem.2024.108020 |
https://www.sciencedirect.com/science/article/abs/pii/S1476927124000082 |
X |
| 3 |
2024-01-03 |
Tuning of end-groups in diketopyrrolopyrrole-based acceptors molecules for organic photovoltaics |
Authors |
Sustainable Chemistry for the Environment, 5 (XXX) |
100068 |
5.66 |
2949-8392 |
XXX |
https://doi.org/10.1016/j.scenv.2024.100068 |
https://www.sciencedirect.com/science/article/pii/S2949839224000117 |
None |
| 4 |
2024-08-02 |
Use of hybrid molecular simulation techniques for systematic analysis of polyphenols as promising therapeutic agent against SARS-CoV-2 |
Authors |
Journal of Molecular Structure, 1305 (XXX) |
137744 |
3.80 |
1872-8014 |
0022-2860 |
https://doi.org/10.1016/j.molstruc.2024.137744 |
https://www.sciencedirect.com/science/article/abs/pii/S0022286024002679 |
W |
| 5 |
2023-12-12 |
A DFT study on removal of Mn and V from wastewater using chitosan/graphene oxide composite as adsorbent |
Authors |
Chemistry of Inorganic Materials, XXX (XXX) |
100030 |
8.60 |
2949-7469 |
XXX |
https://doi.org/10.1016/j.cinorg.2023.100030 |
https://www.sciencedirect.com/science/article/pii/S2949746923000307 |
None |
| 6 |
2023-11-01 |
Solvent impact on the photochemical properties of anticancer drug PLX4720; a computational study |
Authors |
Inorganic Chemistry Communications, 157 (XXX) |
111424 |
3.80 |
1879-0259 |
1387-7003 |
https://doi.org/10.1016/j.inoche.2023.111424 |
https://www.sciencedirect.com/science/article/abs/pii/S1387700323010365 |
X |
| 7 |
2023-08-01 |
Newly efficient designed benzothiadiazole (ADADA topology) based materials for organic photovoltaics: DFT Study |
Authors |
Materials Today Communications, 36 (XXX) |
106481 |
3.80 |
2352-4928 |
XXX |
https://doi.org/10.1016/j.mtcomm.2023.106481 |
https://www.sciencedirect.com/science/article/abs/pii/S2352492823011728 |
W |
