Package: wnpp Owner: Andrius Merkys <mer...@debian.org> Severity: wishlist
* Package name : molmodel Version : 2.2 Upstream Author : Christopher Bruns, Michael Sherman and others * URL : https://simtk.org/projects/molmodel * License : Expat Programming Lang: C++ Description : SimTK molecular modeling API Molmodel is a programmer’s toolkit for building reduced-coordinate, yet still all-atom, models of large biopolymers such as proteins, RNA, and DNA. You control the allowed mobility. By default, Molmodel builds torsion-coordinate models in which bond stretch and bend angles are rigid while bond torsion angles are mobile. But you can rigidify or free any subsets of the atoms. Molmodel is a C++ API for biochemist-friendly molecular modeling that extends the Simbody API to simplify construction of high-performance articulated models of molecules. Molmodel is a dependency of MacroMoleculeBuilder, which I intend to eventually package.
