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1 change: 1 addition & 0 deletions RELEASE-NOTES.md
Original file line number Diff line number Diff line change
Expand Up @@ -8,6 +8,7 @@

- Add `check_test_point` method to `pm.Model`
- Add `Ordered` Transformation and `OrderedLogistic` distribution
- Better warning message for `Mass matrix contains zeros on the diagonal. Some derivatives might always be zero`

### Fixes

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2 changes: 1 addition & 1 deletion pymc3/step_methods/hmc/base_hmc.py
Original file line number Diff line number Diff line change
Expand Up @@ -112,7 +112,7 @@ def astep(self, q0):
start = self.integrator.compute_state(q0, p0)

if not np.isfinite(start.energy):
self.potential.raise_ok()
self.potential.raise_ok(self._logp_dlogp_func._ordering.vmap)
raise ValueError('Bad initial energy: %s. The model '
'might be misspecified.' % start.energy)

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33 changes: 26 additions & 7 deletions pymc3/step_methods/hmc/quadpotential.py
Original file line number Diff line number Diff line change
Expand Up @@ -185,15 +185,34 @@ def update(self, sample, grad, tune):

self._n_samples += 1

def raise_ok(self):
def raise_ok(self, vmap):
if np.any(self._stds == 0):
raise ValueError('Mass matrix contains zeros on the diagonal. '
'Some derivatives might always be zero.')
if np.any(self._stds < 0):
raise ValueError('Mass matrix contains negative values on the '
'diagonal.')
name_slc = []
tmp_hold = list(range(self._stds.size))
for vmap_ in vmap:
slclen = len(tmp_hold[vmap_.slc])
for i in range(slclen):
name_slc.append((vmap_.var, i))
index = np.where(self._stds == 0)[0]
errmsg = ['Mass matrix contains zeros on the diagonal. ']
for ii in index:
errmsg.append('The derivative of RV `{}`.ravel()[{}]'
' is zero.'.format(*name_slc[ii]))
raise ValueError('\n'.join(errmsg))

if np.any(~np.isfinite(self._stds)):
raise ValueError('Mass matrix contains non-finite values.')
name_slc = []
tmp_hold = list(range(self._stds.size))
for vmap_ in vmap:
slclen = len(tmp_hold[vmap_.slc])
for i in range(slclen):
name_slc.append((vmap_.var, i))
index = np.where(~np.isfinite(self._stds))[0]
errmsg = ['Mass matrix contains non-finite values on the diagonal. ']
for ii in index:
errmsg.append('The derivative of RV `{}`.ravel()[{}]'
' is non-finite.'.format(*name_slc[ii]))
raise ValueError('\n'.join(errmsg))


class QuadPotentialDiagAdaptGrad(QuadPotentialDiagAdapt):
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