most citedLocal softness, softness dipole and polarizabilities of functional groups: application to the side chains of the twenty amino acids

36 citations · 36 across the 1 of their papers we have counts for

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1 paper

physics.chem-ph2010★ 36 cited

Local softness, softness dipole and polarizabilities of functional groups: application to the side chains of the twenty amino acids

Alisa Krishta, Patrick Senet, Christian Van Alsenoy

The values of molecular polarizabilities and softnesses of the twenty amino acids were computed ab initio (MP2). By using the iterative Hirshfeld scheme to partition the molecular…