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Ragzouken committed Oct 11, 2024
2 parents 6177db3 + 7e855f8 commit f772386
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"\n",
"This notebook showed a toy example with ASE. \n",
"\n",
"* Run bigger molecular mechanics simulations with OpenMM. The [nanotube](./openmm_nanotube.ipynb) and [neuraminidase](./openmm_neuraminidase.ipynb) examples show how to set up simulations with OpenMM.\n",
"* Run bigger molecular mechanics simulations with OpenMM. The [nanotube](./ase_openmm_nanotube.ipynb) and [neuraminidase](./ase_openmm_neuraminidase.ipynb) examples show how to set up simulations with OpenMM.\n",
"* To understand what's going on under the hood, consider starting with the [NanoVer frame explained](../fundamentals/frame.ipynb) example. "
]
}
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