Algorithmic Challenges in Computational Molecular Biophysics
A perspective of biomolecular simulation today is given, with illustrative
applications and an emphasis on algorithmic challenges, as reflected by
the work of a multidisciplinary team of investigators from five institutions.
Included are the overviews and recent descriptions of algorithmic work
in long-time integration for molecular dynamics, fast electrostatic evaluation,
crystallographic refinement approaches, and implementation of large, computer-intensive
programs on modern architectures. Expected future developments of the field
are also discussed.
Click to go back to the publication list
Webpage design by Igor Zilberman