Concepedia

Synthesis, spectral, single crystal XRD structure, Hirshfeld surface, molecular docking and in silico ADMET studies of symmetrical azine: 1,2-bis(4 (methylthio) benzylidene)hydrazine

S. Ramkumar, R. Rajalakshmi

Materials Today Proceedings · 2023 · 13 citations · 31 references

DOI

Concepts

References

31

Phase annealing in SHELX-90: direct methods for larger structures

George M. Sheldrick · Acta Crystallographica Section A Foundations of Crystallography · 1990 · 16.3K citations

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Hirshfeld surface analysis

Mark A. Spackman, Dylan Jayatilaka · CrystEngComm · 2008 · 7.8K citations

, , +12

Bonded-atom fragments for describing molecular charge densities

F. L. Hirshfeld · Theoretical Chemistry Accounts · 1977 · 6.9K citations

, , +14

Fingerprinting intermolecular interactions in molecular crystals

Mark A. Spackman, Joshua J. McKinnon · CrystEngComm · 2002 · 4K citations

, , +17

Prediction of Drug Absorption Using Multivariate Statistics

William J. Egan, Kenneth M. Merz, John J. Baldwin · Journal of Medicinal Chemistry · 2000 · 1.9K citations

, , +14