Zernike multi-core fingerprinting broken

[Zachary Ulissi]

trying to train with multiple cores and Zernike fingerprints fails on the worker processes fails because FingerprintCalculator is being called without the fortran argument

init for FingerprintCalculator: init(self, neighborlist, Gs, nmax, cutoff, cutofffn, fortran):

Call in main: calc = FingerprintCalculator(neighborlist, Gs, nmax, cutoff, cutofffn)

Also, self.parallel_command = 'calculate_fingerprint_prime' should be self.parallel_command = 'calculate_fingerprint_primes'

And: calc = FingerprintPrimeCalculator(neighborlist, Gs,cutoff, cutofffn) is missing the nmax and fortran arguments

And: the checks for the cutoff function also throws errors for me (cutofffn is 'Cosine'), perhaps due to a type change in the parallel code. cutofffn == 'Cosine' etc fixes this

[Alireza Khorshidi]

Thanks Zack! Should be fixed in the commit 833fdd5.