Toward More Reliable 13 C and 1 H Chemical Shift Prediction: A Systematic Comparison of Neural-Network and Least-Squares Regression Based Approaches
Smurnyy, Yegor D., Blinov, Kirill A., Churanova, Tatiana S., Elyashberg, Mikhail E., Williams, Antony J.Volume:
48
Language:
english
Journal:
Journal of Chemical Information and Modeling
DOI:
10.1021/ci700256n
Date:
January, 2008
File:
PDF, 154 KB
english, 2008