Evaluating Polarizable Potentials on Distributed Memory Parallel Computers: Program Development and Applications. - Dan N. Bernardo; Yanbo Ding; Karsten Krogh-Jespersen; Ronald M. Levy (J. Comput. Chem., 1995)

The 1: 1 glycine zwitterion-water complex: An ab initio electronic structure study. - Yanbo Ding; Karsten Krogh-Jespersen (J. Comput. Chem., 1996)

DFT/ECP Study of C-H Activation by (PCP)Ir and (PCP)Ir(H)2 (PCP = 3-1, 3-C6H3(CH2PR2)2). Enthalpies and Free Energies of Associative and Dissociative Pathways. - Karsten Krogh-Jespersen; Margaret Czerw; Mira Kanzelberger; Alan S. Goldman (J. Chem. Inf. Comput. Sci., 2001)