Name | Data | License | Technology | Citation | Comments |
Amira | EM MRI Optical | commercial |
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Ascalaph Graphics | MM MD | free | C++ |
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Avizo | EM MM MRI Optical XRC | commercial | Windows, Linux, Mac |
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Avogadro | MM XRC MD | free and open-source | C++/Qt, can be extended with Python modules |
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BALLView | MM Nucleic Acids XRC SMI | free and open-source, GPL | C++ and Python; Windows, Linux, Solaris, and MacOS X | BALL project | BALLView uses OpenGL and the real time ray tracer RTFact as render backends. For both renderers, BALLView offers stereoscopic visualization in several different modes. |
Cn3D |
| free | stand-alone application |
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CheVi | SMI | free | stand-alone application |
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Coot |
| free |
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Crystal Studio | MM XRC | commercial | Windows |
| Various Models: Ball & Stick, Stick, Space Filling, Ribbon etc. Plot XRD and Neutron Powder Patterns |
Friend | MM SA MSA | free | Win, Linux |
| Fast, can work with hundreds of structures and thousands of sequences; millions of atoms. Crosstalk between sequence and structure modules. Sequence module based on Jalview. Accurate structural alignment by TOPOFIT method. Also available as applet to interface sequence/structure databases. |
Gabedit | XRC MM | free and open-source | C |
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g0penMol | MD MM | free |
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ICM-Browser |
| free | Windows,Mac,Linux, fast C++ graphics, free plugin and activeICM for Web delivery |
| multiple objects, symmerty, 3D wavefront, alignments, chemistry, tables, plots |
Jmol |
| free and open-source | Java applet or stand-alone application |
| Supports advanced capabilities such as loading multiple molecules with independent movement, surfaces and molecular orbitals, cavity visualization, crystal symmetry |
MDL Chime |
| free for noncommercial use, proprietary | C++ browser plugin for Windows only |
| Calculates molecular surfaces coloured by electrostatic or hydrophobic potential. Originally based on RasMol. |
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Molden | MM XRC |
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MOE | MM XRC | commercial |
| Molecular Operating Environment (MOE) |
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Molekel | MM XRC | free and open-source | Java3D applet or stand-alone application |
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NOCH |
| free and open-source |
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O |
| free for noncommercial use |
|
| see also [1] |
PyMOL | XRC SMI EM | free for noncommercial use, open-source | Python |
| According to the author, almost a quarter of all published images of 3D protein structures in the scientific literature were made using PyMOL.[citation needed] |
Qmol | MM | free, open-source | C |
| Provided by DNASTAR |
RasMol |
| free and open-source | C stand-alone application |
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Sirius |
| free and open-source | Java3D applet or stand-alone application |
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SPARTAN | MM QM | commercial | stand-alone application |
| visualize and edit biomolecules, extract bound ligands from PDB files for further computational analysis, full molecular mechanics and quantum chemical calculations package with streamlined graphical user interface. |
SRS3D Viewer | HM | free and open-source | Java3D applet or stand-alone application |
| Integrates 3D structures with sequence and feature data (domains, SNPs, etc.). |
UCSF Chimera | XRC SMI EM MD | free for noncommercial use | Python |
| Includes single/multiple sequence viewer, structure-based sequence alignment, automatic sequence-structure crosstalk for integrated analyses.[29] |
VMD | EM MD MM | free for noncommercial use | C++ |
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WebMol |
| free | Java applet and stand-alone |
| Includes advanced structural analysis features such as packing of secondary structural elements and surface calculations. |
WHAT IF | HM XRC | shareware for academics | stand-alone |
| Old-fashioned interface; very good software for the experienced bioinformatician; nearly 2000 protein-structure related options; comes with 500 page writeup. |
Yasara | HM NMR XRC | commercial; free version for education and elementary structure work | stand-alone |
| Very advanced graphics; Best in homology model optimisation in CASP-2008; many drug design options; |
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