DFT Based Atomic Softness and Its Application in Site Selectivity

Journal article

P. P. Singh, F. A. Pasha, H. K. Srivastava and F. A. Pasha

QSAR & combinatorial science, Vol.22(8), pp.843-851

11/2003

Abstract

Eigen values

QSPR

Regioselectivity

Site selectivity

Softness

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Title: DFT Based Atomic Softness and Its Application in Site Selectivity
Creators - without role: P. P. Singh - Department of Chemistry M. L. K. (P. G.) College Balrampur, (U.P.), INDIA
F. A. Pasha - Department of Chemistry, Bareilly College Bareilly, (U. P.), INDIA
H. K. Srivastava - Department of Chemistry M. L. K. (P. G.) College Balrampur, (U.P.), INDIA
F. A. Pasha - King Abdullah University of Science & Technology
Publication Details: QSAR & combinatorial science, Vol.22(8), pp.843-851
Publisher: WILEY-VCH Verlag
Number of pages: 9
Identifiers: 9942882508331
Academic Unit: King Abdullah University of Science & Technology
Language: English
Resource Type: Journal article