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Koo JCP; Lam JSW; Salpietro SJ; Chasse Gregory Adam; Enriz RD; Torday László; Varró András; Papp Gyula:
How reliable could economic Hartree-Fock computations be in studying large, folded peptides? A comparative HF and DFT case study on N- and C-protected aspartic acid.
JOURNAL OF MOLECULAR STRUCTURE: THEOCHEM, 619 (1-3).
pp. 143-194.
ISSN 0166-1280
(2002)