Concepedia

Structural basis of antibacterial photodynamic action of curcumin against S. aureus

Lucas D. Dias, Antônio S. N. Aguiar, Nicolas Junhiti de Melo, Natália Mayumi Inada, Leonardo Luíz Borges, Gilberto L. B. Aquino, Ademir J. Camargo, Vanderlei Salvador Bagnato, Hamilton B. Napolitano

Photodiagnosis and Photodynamic Therapy · 2023 · 11 citations · 45 references

DOI

Concepts

References

45

Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text

, , +15

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

Yan Zhao, Donald G. Truhlar · Theoretical Chemistry Accounts · 2007 · 30K citations · Full text

, , +17

A new hybrid exchange–correlation functional using the Coulomb-attenuating method (CAM-B3LYP)

Takeshi Yanai, David P. Tew, Nicholas C. Handy · Chemical Physics Letters · 2004 · 14.8K citations

, , +12

Electrophilicity Index

Robert G. Parr, László von Szentpály, Shubin Liu · Journal of the American Chemical Society · 1999 · 7.3K citations

, , +3

Development and validation of a genetic algorithm for flexible docking 1 1Edited by F. E. Cohen

Gareth Jones, Peter Willett, Robert C. Glen et al. · Journal of Molecular Biology · 1997 · 6.7K citations

, , +14