G. Schaftenaar,
E. Vlieg, G. Vriend,
Molden 2.0: quantum chemistry meets proteins,
J. Comput Aided Mol. Des. 31 (2017) 789-800
Abstract
Since the first distribution
of Molden in 1995
and the publication of the
first article about this software in
2000 work on Molden has continued relentlessly. A few of
the many improved or fully
novel features such as improved
and broadened support for
quantum chemistry calculations,
preparation of ligands for
use in drug design related soft-
wares, and working with
proteins for the purpose of ligand
docking.