Capabilities
Engine |
Known bugs |
4-site water models |
5-site water models |
Virtual sites on ligands |
Proteins |
Nucleic acids |
Lipids |
Carbohydrates |
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All |
No supported SMIRNOFF force fields | ||||||||||
OpenMM |
Supported |
Supported |
Supported |
Supported |
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GROMACS |
Partially supported |
Supported |
Partially supported |
Supported |
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Amber |
Unsupported1 |
Unsupported1 |
Unsupported1 |
Supported |
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LAMMPS |
Not supported |
Not supported |
Not supported |
Not tested |
Unable to find upstream documentation