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Browsing by Subject DFT calculations
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Issue Date | Title | Author(s) | 2015 | ) Design and development of molecularly imprinted polymers for the selective extraction of deltamethrin in olive oil: an integrated computational-assisted approach | Martins, Nuno; Carreiro, Elisabete; Locati, Abel; Ramalho, João Prates; Cabrita, Maria João; Burke, Anthony J.; Garcia, Raquel |
Jan-2021 | Insights into adsorptive interactions between antibiotic molecules and rutile-TiO2 (110) surface | Tri, Nguyen Ngoc; Ho, Dai Q.; Carvalho, Alfredo J. Palace; Nguyen, Minh Tho; Trung, Nguyen Tien |
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