output
20072026
most citedComputer Modeling of Halogen Bonds and Other -Hole Interactions

653 citations

researchers with a paper here

Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.

collaborating institutions
Showing cond-mat.softShow all

2 papers · 1 filter

cond-mat.soft2020★ 101 cited

Guanidinium can both Cause and Prevent the Hydrophobic Collapse of Biomacromolecules

Jan Heyda, Halil I. Okur, Jana Hladílková +6

A combination of Fourier transform infrared and phase transition measurements as well as molecular computer simulations, and thermodynamic modeling were performed to probe the mech…

cond-mat.soft2008★ 42 cited

Ab initio investigation of intermolecular interactions in solid benzene

O. Bludsky, M. Rubes, P. Soldan

A computational strategy for the evaluation of the crystal lattice constants and cohesive energy of the weakly bound molecular solids is proposed. The strategy is based on the high…