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...Charmol is capable of making pictures containing:
- from small- to large-size molecules
- more molecules together (different settings possible)
- orbitals using molden and fchk files (GTO functions up to 'h' angular momentum supported)
- surfaces using gaussian cube files (also color-mapped surfaces according to potential)
- schematic representation of vibrations using arrows
- user-defined arrows representing vectorial properties
- measuring gauges
- combinations of these features (more orbitals together, orbitals and arrows together etc.)
...
Open source electronic lab notebook (ELN) for scientists
sciNote is an open source electronic lab notebook (ELN) that helps you manage your laboratory work and stores all your experimental data in one place. sciNote is specifically designed for life science students, researchers, lab technicians and group leaders.
BASILISK is a probabilistic model of the conformational space of amino acid side chains in proteins. Unlike rotamer libraries, BASILISK models the chi angles in continuous space, including the influence of the protein's backbone.