![]()
Application Protein T162
|
OPT++ | |||||||
|
OPT++ is an object-oriented nonlinear optimization package. It solves optimization problems of the form
in which the user specifies the function f (and, when available, its first and second analytical derivatives) and the functions h and g. OPT++ provides many different solution algorithms including:
OPT++ can be used to solve general nonlinear constrained optimization problems as defined above. The image in the left panel comes from an energy minimization problem for the protein T162, from CASP5 (click on the icon to display the full image in a new window). The initial configuration was created with ProteinShop and the minimization was computed with OPT++/LBFGS.
OPT++ was developed at the the Computational Sciences and Mathematics Research Department at Sandia National Laboratories. The original author was Juan Meza with substantial contributions by Patty Hough and Pamela Williams |
||||||||
|
||||||||