+ DOI: 10.1021/ct700301q
+
+* GROMACS 4.5: a high-throughput and highly parallel open source
+ molecular simulation toolkit
+ Sander Pronk, Szilárd Páll, Roland Schulz, Per Larsson, Pär Bjelkmar,
+ Rossen Apostolov, Michael R. Shirts, Jeremy C. Smith, Peter M. Kasson,
+ David van der Spoel, Berk Hess, Erik Lindahl.
+ Bioinformatics 29 (2013) pp. 845-54
+ DOI: 10.1093/bioinformatics/btt055