Concepedia

Development of a Targeted Polymorph Screening Approach for a Complex Polymorphic and Highly Solvating API

Anthony M. Campeta, Brian P. Chekal, Yuriy A. Abramov, Paul Meenan, Mark J. Henson, Bing Shi, Robert A. Singer, Keith R. Horspool

Journal of Pharmaceutical Sciences · 2010 · 135 citations · 17 references

DOI

Concepts

References

17

Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text

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Density-functional exchange-energy approximation with correct asymptotic behavior

Axel D. Becke · Physical review. A, General physics · 1988 · 53.5K citations

, , +17

Density-functional approximation for the correlation energy of the inhomogeneous electron gas

John P. Perdew · Physical review. B, Condensed matter · 1986 · 18.7K citations

, , +11

Ritonavir: An Extraordinary Example of Conformational Polymorphism

John F. Bauer, Stephen G. Spanton, Rodger F. Henry et al. · Pharmaceutical Research · 2001 · 1.1K citations

, , +9

Incorporation of solvent effects into density functional calculations of molecular energies and geometries

Jan Andzelm, Christoph Kölmel, Andreas Klamt · The Journal of Chemical Physics · 1995 · 854 citations

, , +15