Calculation of Molecular Geometries, Relative Conformational Energies, Dipole Moments, and Molecular Electrostatic Potential Fitted Charges of Small Organic Molecules of Biochemical Interest by Density Function Theory

Alain St.-Amant, Wendy D. Cornell, Peter A. Kollman, Thomas A. Halgren. Calculation of Molecular Geometries, Relative Conformational Energies, Dipole Moments, and Molecular Electrostatic Potential Fitted Charges of Small Organic Molecules of Biochemical Interest by Density Function Theory. Journal of Computational Chemistry, 16(12):1483-1506, 1995.

References

No references recorded for this publication.

Cited by

No citations of this publication recorded.