DFT and molecular docking insights into barium- and polyacrylic acid-integrated nickel selenide for efficient dye reduction and biological applications
Anum Shahzadi, Ali Haider, Nelofer Aslam, Hafsa Saeed, Anwar Ul-Hamid, Muhammad Ali Khan, Samira Elaissi, Muhammad Ikram · 2026
Read DFT and molecular docking insights into barium- and polyacrylic acid-integrated nickel selenide for efficient dye reduction and biological applications by Anum Shahzadi, Ali Haider, Nelofer Aslam, Hafsa Saeed, Anwar Ul-Hamid, Muhammad Ali Khan, Samira Elaissi, Muhammad Ikram (2026) in the Tower of Babel, a free online library of public-domain works preserved in clean, searchable text. No sign-up. The full text is served as a plain-text file at a predictable URL, where text is present: https://antarctic-labs.com/tower-of-babel/pmc-13552419.txt.
Description
Anum Shahzadi and co-authors study a treated mineral powder that can clean dye from water and fight germs, in a paper from 2026. Factory waste has made clean water harder to get in many places. The base material here is nickel selenide, a compound that can speed up chemical change.
The team made the powder with two added parts, barium and a common plastic acid, by a simple mixing route. They checked its crystal form, shape, and light behavior with a range of lab tools. The best mix removed most of a pink dye from water under neutral conditions. Computer docking tests and theory work round out the study, which points to uses in cleaning waste water and in health related tasks.
Catalog record
| CREATOR | Anum Shahzadi, Ali Haider, Nelofer Aslam, Hafsa Saeed, Anwar Ul-Hamid, Muhammad Ali Khan, Samira Elaissi, Muhammad Ikram |
|---|---|
| YEAR | 2026 |
| COLLECTION | PAPERS |
| FORMAT | TXT |
| FILE SIZE | 31 KB |
| VERSION | 1.0 |
| LICENSE | CC BY 4.0 |
| RIGHTS | CC BY |
| SOURCE | Europe PMC |