| 1 |
Optimization of an AMBER Force Field for the Artificial Nucleic Acid, LNA, and Benchmarking with NMR of L(CAAU)
Condon DE, Yildirim I, Kennedy SD, Mort BC, Kierzek R, Turner DH
Journal of Physical Chemistry B, 118(5), 1216, 2014 |
| 2 |
Vibrational corrections to magneto-optical rotation: A computational study
Mort BC, Autschbach J
Journal of Physical Chemistry A, 111(25), 5563, 2007 |
| 3 |
Temperature dependence of the optical rotation of fenchone calculated by vibrational averaging
Mort BC, Autschbach J
Journal of Physical Chemistry A, 110(40), 11381, 2006 |
| 4 |
Zero-point corrections and temperature dependence of HD spin-spin coupling constants of heavy metal hydride and dihydrogen complexes calculated by vibrational averaging
Mort BC, Autschbach J
Journal of the American Chemical Society, 128(31), 10060, 2006 |
| 5 |
Magnitude of zero-point vibrational corrections to optical rotation in rigid organic molecules: A time-dependent density functional study
Mort BC, Autschbach J
Journal of Physical Chemistry A, 109(38), 8617, 2005 |
