Our new paper :

Svetlana Artemova, Sergei Grudinin and Stephane Redon. A comparison of neighbor search algorithms for large rigid molecules.

was accepted to the Journal of Computational Chemistry. The paper compares the well-known grid-based neighbor-search method to several bounding-volume-based methods in the case of large, rigid molecules.

Congrats again to Svetlana, the paper’s first author!