Concepedia

Keith W. Wiitala

KW

4

Publications

250

Citations

4

H-Index

1992

Active since

Affiliations

University of Minnesota(Current)

Keith W. Wiitala is an author at University of Minnesota specializing in engineering, molecular modeling, and organic chemistry.

Top concepts

EngineeringChemistryBiochemistryNatural SciencesOrganic ChemistryQuantum ChemistryMolecular ModelingComputational ChemistrySolution Nmr SpectroscopyPeptide Science

Publications per year

1992–2007

4

Publications

4

Hybrid Density Functional Methods Empirically Optimized for the Computation of <sup>13</sup>C and <sup>1</sup>H Chemical Shifts in Chloroform Solution

Keith W. Wiitala, Thomas R. Hoye, Christopher J. Cramer · Journal of Chemical Theory and Computation · 2006 · 161 citations

Engineering, Chemical Analysis, Computational Chemistry +20

Comparison of various density functional methods for distinguishing stereoisomers based on computed <sup>1</sup>H or <sup>13</sup>C NMR chemical shifts using diastereomeric penam β‐lactams as a test set

Keith W. Wiitala, Christopher J. Cramer, Thomas R. Hoye · Magnetic Resonance in Chemistry · 2007 · 49 citations

Evaluation of various DFT protocols for computing <sup>1</sup>H and <sup>13</sup>C chemical shifts to distinguish stereoisomers: diastereomeric 2‐, 3‐, and 4‐methylcyclohexanols as a test set

Keith W. Wiitala, Z.F. Al-Rashid, Vadims Dvornikovs et al. · Journal of Physical Organic Chemistry · 2007 · 29 citations

Engineering, Chemical Analysis, Conformational Isomers +19

The synthesis of 7α-amidocarbacephems

Christina Bodurow, Jeffrey N. Levy, Keith W. Wiitala · Tetrahedron Letters · 1992 · 11 citations

Engineering, Diversity-oriented Synthesis, Organic Chemistry +3

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