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Journal of Biomolecular Structure & Dynamics
|
September 19, 2020
<i>In silico</i> drug discovery of IKK-β inhibitors from 2-amino-3-cyano-4-alkyl-6-(2-hydroxyphenyl) pyridine derivatives based on QSAR, docking, molecular dynamics and drug-likeness evaluation studies
Nour-El-Houda Hammoudi, Yacine Benguerba, Ayoub Attoui, et al.
Heliyon
|
March 7, 2024
Removal of textile pollutants from aqueous medium using biosynthesized CuO nanoparticles: Theoretical comparative investigation via analytical model
Afrah Atri, Fatma Dhaouadi, Nesrine Mechi, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 6, 2021
Adsorption of water in Na-LTA zeolites: an ab initio molecular dynamics investigation
Joharimanitra Randrianandraina, Michael Badawi, Bruno Cardey, et al.
Heliyon
|
May 6, 2020
Copper-enriched diamond-like carbon coatings promote regeneration at the bone-implant interface
Peiman Brouki Milan, Sara Khamseh, Payam Zarrintaj, et al.
Journal of Environmental Management
|
February 2, 2023
Valorization of biowastes for clean energy production, environmental depollution and soil fertility
Rajesh K Srivastava, Nagaraj P Shetti, Kakarla Raghava Reddy, et al.
International Journal of Biological Macromolecules
|
March 22, 2025
Extraction of highly crystalline and thermally stable cellulose nanofiber from Heliconia psittacorum L.f. leaves
Sharon Paul, Anto Joseph, P D Hridhya, et al.
Journal of Colloid and Interface Science
|
October 11, 2020
Adsorption mechanisms of fatty acids on fluorite unraveled by infrared spectroscopy and first-principles calculations
Yann Foucaud, Juliette Lainé, Lev O Filippov, et al.
Chemosphere
|
July 14, 2024
Removal of phenazopyridine from water, synthetic urine, and real sample by adsorption using graphene oxide: A DFT theoretical/experimental approach
Franciele da Silva Bruckmann, Yann Foucaud, Raphael Forgearini Pinheiro, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
November 27, 2024
Modulating the Iron Microenvironment for a Cooperative Interplay Between Fe-N-C Single Atoms and Fe<sub>3</sub>C Nanoclusters on the Oxygen Reduction Reaction
Anthony Dessalle, Javier Quílez-Bermejo, Jean Wilfried Hounfodji, et al.
Journal of Molecular Modeling
|
July 24, 2019
Quantum mechanistic study of furan and 2-methylfuran hydrodeoxygenation on molybdenum and tungsten sulfide clusters
Wilfried G Kanhounnon, Urbain A Kuevi, Gaston A Kpotin, et al.
Page
of 9
Search research articles
Search
Showing results (61-70 of 82) with videos related to
Sort By:
Page
of 9
Journal of Biomolecular Structure & Dynamics
|
September 19, 2020
<i>In silico</i> drug discovery of IKK-β inhibitors from 2-amino-3-cyano-4-alkyl-6-(2-hydroxyphenyl) pyridine derivatives based on QSAR, docking, molecular dynamics and drug-likeness evaluation studies
Nour-El-Houda Hammoudi, Yacine Benguerba, Ayoub Attoui, et al.
Heliyon
|
March 7, 2024
Removal of textile pollutants from aqueous medium using biosynthesized CuO nanoparticles: Theoretical comparative investigation via analytical model
Afrah Atri, Fatma Dhaouadi, Nesrine Mechi, et al.
Physical Chemistry Chemical Physics : PCCP
|
October 6, 2021
Adsorption of water in Na-LTA zeolites: an ab initio molecular dynamics investigation
Joharimanitra Randrianandraina, Michael Badawi, Bruno Cardey, et al.
Heliyon
|
May 6, 2020
Copper-enriched diamond-like carbon coatings promote regeneration at the bone-implant interface
Peiman Brouki Milan, Sara Khamseh, Payam Zarrintaj, et al.
Journal of Environmental Management
|
February 2, 2023
Valorization of biowastes for clean energy production, environmental depollution and soil fertility
Rajesh K Srivastava, Nagaraj P Shetti, Kakarla Raghava Reddy, et al.
International Journal of Biological Macromolecules
|
March 22, 2025
Extraction of highly crystalline and thermally stable cellulose nanofiber from Heliconia psittacorum L.f. leaves
Sharon Paul, Anto Joseph, P D Hridhya, et al.
Journal of Colloid and Interface Science
|
October 11, 2020
Adsorption mechanisms of fatty acids on fluorite unraveled by infrared spectroscopy and first-principles calculations
Yann Foucaud, Juliette Lainé, Lev O Filippov, et al.
Chemosphere
|
July 14, 2024
Removal of phenazopyridine from water, synthetic urine, and real sample by adsorption using graphene oxide: A DFT theoretical/experimental approach
Franciele da Silva Bruckmann, Yann Foucaud, Raphael Forgearini Pinheiro, et al.
Small (Weinheim an Der Bergstrasse, Germany)
|
November 27, 2024
Modulating the Iron Microenvironment for a Cooperative Interplay Between Fe-N-C Single Atoms and Fe<sub>3</sub>C Nanoclusters on the Oxygen Reduction Reaction
Anthony Dessalle, Javier Quílez-Bermejo, Jean Wilfried Hounfodji, et al.
Journal of Molecular Modeling
|
July 24, 2019
Quantum mechanistic study of furan and 2-methylfuran hydrodeoxygenation on molybdenum and tungsten sulfide clusters
Wilfried G Kanhounnon, Urbain A Kuevi, Gaston A Kpotin, et al.
Page
of 9