1. Andrew Peterson Avatar Andrew Peterson
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  3. Amp

Issues

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Issues (126–150 of 238)

Title T P Status Votes Assignee Created Updated Actions
#137: tflow BFGS optimizer doesn't update model parameters if it doesn't converge
bug minor new
#55: Move train parameters to LossFunction
proposal minor resolved
#60: Revisiting force training keyword
bug major resolved
#65: descriptor fortran keywords
enhancement minor resolved
#67: Amp.load needs a unit test
enhancement major resolved
#131: Instructions for fortran modules
proposal minor resolved
#133: Why biases are excluded from l2_regularization term?
proposal minor new
#130: Where should matplotlib.use('Agg') be?
proposal minor resolved
#120: Remove FIXME's
bug major resolved
#104: Assertion for "force_consistent=True"
enhancement minor new
#52: Document forces in descriptor
proposal major resolved
#83: symmetry of fingerprint primes
task major resolved
#46: Replcaing png figures with svg format.
enhancement minor resolved
#48: relative imports should be returned back.
enhancement major resolved
#30: new method: get_forces(self, ....)
bug major resolved
#22: Propagate flags in train()
proposal minor resolved
#81: Fingerprint analysis tool
enhancement minor resolved
#47: Fingerprints_range in v0.4
bug major wontfix
#123: Rename get -> calculate?
proposal minor resolved
#75: Difficulty training to simple (Lennard-Jones) model
bug major resolved
#108: Document the convergence plot
enhancement minor resolved
#96: Amp doesn't reset calculator results when parameters changed
bug minor resolved
#51: Remove "set" method?
bug minor resolved
#11: save_memory
enhancement major resolved
#121: Option to turn off logging
enhancement minor resolved
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