K Kolmodin

发表

Q: a molecular dynamics program for free energy calculations and empirical valence bond simulations in biomolecular systems.

J. Åqvist, I. Feierberg, J. Åqvist, 1998, Journal of molecular graphics & modelling.

Mechanistic alternatives in phosphate monoester hydrolysis: what conclusions can be drawn from available experimental data?

A. Warshel, J. Åqvist, J. Florián, 1999, Chemistry & biology.

Design, synthesis, computational prediction, and biological evaluation of ester soft drugs as inhibitors of dihydrofolate reductase from Pneumocystis carinii.

S F Queener, J Aqvist, A Hallberg, 2001, Journal of medicinal chemistry.