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
Saved in:
Main Authors: | |
---|---|
Format: | Article |
Published: |
2002
|
Series: | JOURNAL OF MOLECULAR STRUCTURE: THEOCHEM
619 No. 1-3 |
Subjects: | |
doi: | 10.1016/S0166-1280(02)00579-1 |
mtmt: | 1397656 |
Online Access: | http://publicatio.bibl.u-szeged.hu/28644 |
Physical Description: | 143-194 |
---|---|
ISSN: | 0166-1280 |