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ForceBalance API
1.3
Automated optimization of force fields and empirical potentials
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This is the complete list of members for src.smirnoffio.TorsionProfileTarget_SMIRNOFF, including all inherited members.
| __init__(self, options, tgt_opts, forcefield) | src.smirnoffio.TorsionProfileTarget_SMIRNOFF | |
| engine_ | src.smirnoffio.TorsionProfileTarget_SMIRNOFF | |
| pgrad | src.smirnoffio.TorsionProfileTarget_SMIRNOFF | |
| smirnoff_update_pgrads(self) | src.smirnoffio.TorsionProfileTarget_SMIRNOFF | |
| submit_jobs(self, mvals, AGrad=False, AHess=False) | src.smirnoffio.TorsionProfileTarget_SMIRNOFF |
1.8.13