TY  - JOUR
AU  - Suardíaz Delrío, Reynier
AU  - Pérez, Carlos
AU  - García de la Vega, José 
AU  - San Fabián, Jesús
AU  - Contreras, Rubén 
PY  - 2007
DO  - 10.1016/j.cplett.2007.05.049
SN  - 0009-2614
UR  - https://hdl.handle.net/20.500.14352/92306
T2  - Chemical Physics Letters
AB  - Karplus coefficients for χ1-related vicinal coupling constants in Valine dipeptide model, obtained from DFT calculations are reported. The computed coefficients agree with available experimental data, excepting C1 coefficient that is obtained with...
LA  - eng
M2  - 119
PB  - Elsevier
TI  - Theoretical Karplus relationships for vicinal coupling constants around χ1 in Valine
TY  - journal article
VL  - 442
ER  -