Concepedia

Preparation and characterization of spiro-acridine derivative and 2-hydroxypropyl-β-cyclodextrin inclusion complex

Camila de Oliveira Melo, Maria Salete da Silva Rodrigues, Marcus Vinícius Santos da Silva, Henrique Rodrigues Marcelino, Marcelo Montenegro Rabello, Ricardo Olímpio de Moura, Elquio Eleamen Oliveira

Journal of Molecular Structure · 2020 · 14 citations · 53 references

DOI

Concepts

References

53

AutoDock Vina: Improving the speed and accuracy of docking with a new scoring function, efficient optimization, and multithreading

Oleg Trott, Arthur J. Olson · Journal of Computational Chemistry · 2009 · 37.1K citations · Full text

, , +17

Open Babel: An open chemical toolbox

Noel M. O’Boyle, Michael Banck, Craig A. James et al. · Journal of Cheminformatics · 2011 · 11.1K citations · Full text

, , +9

Optimization of parameters for semiempirical methods V: Modification of NDDO approximations and application to 70 elements

James J. P. Stewart · Journal of Molecular Modeling · 2007 · 3.7K citations · Full text

, , +9

Phase solubility techniques

T. Higuchi, A Connors · 1965 · 2.5K citations

MMFF VI. MMFF94s option for energy minimization studies

Thomas A. Halgren · Journal of Computational Chemistry · 1999 · 1.2K citations

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