Installation ============ (0) MOSAICS.X.X These versions are capable of conformational sampling & optimization of biophysical structures including proteins and nucleic acids. Molecular entities/biopolymers can be described at different resolution from one center per monomer (residue/nucleotide) to all atom representation with solvent effect. Definition of the molecular resolution and the corresponding interactions are given by topology & parameter files available in the form of databases through Topology Database & Potential Database links. (1) Download the source code version.X.X.tar.gz (2) Uncompress the source code tar -xvzf version.X.X.tar.gz to create directory structure version.X.X/source version.X.X/examples (3) Compile serial version a) cd source/compile/serial b) edit Makefile to specify library locations c) make clean d) make to create version.X.X/examples/mosaics.x (4) Compile mpi version (From version.4.0 or higher) a) cd source/compile/mpi b) edit Makefile to specify library locations c) make clean d) make to create version.X.X/examples/mosaics_mpi.x (5) Running MOSAICS ./mosaics.x mosaics.input > out For further info please read DOCUMENTATION!
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Command-line version
The source code is available for the following platforms:
- OsX
- Linux
Pymol plugin
This version is available for the following platforms:
- OsX
- Linux
- Windows
NB: try to use Pymol version 1.7 and above -- earlier versions cannot do hydrogen addition very well.
Download the plugin