Thierry Matthey, Trevor M. Cickovski, Scott S. Hampton, Alice Ko, Qun Ma, Matthew Nyerges, Troy Raeder, Thomas Slabach, Jesús A. Izaguirre. ProtoMol, an object-oriented framework for prototyping novel algorithms for molecular dynamics. ACM Transactions on Mathematical Software, 30(3):237-265, 2004. [doi]
Abstract is missing.