[phenixbb] error after adp refinement

[Christian Roth]

Dear Phenix Team,
I started a refinement with anisotropic adp  and weight optimization and 
directly after the optimization step an  error appeared which never appeared 
befor for me.
The previous steps of mask optimization and xyz refinement worked well.

Best Regards

Christian 

AssertionError : 
Traceback:
  File "/userdata-2/christian/phenix-
dev-979/cctbx_project/libtbx/thread_utils.py", line 229, in run
    return_value = self._target(self._args, self._kwargs, self._c)

  File "/userdata-2/christian/phenix-
dev-979/cctbx_project/libtbx/runtime_utils.py", line 72, in __call__
    result = self.target()

  File "/userdata-2/christian/phenix-
dev-979/phenix/phenix/refinement/runtime.py", line 68, in __call__
    call_back_handler=callback)

  File "/userdata-2/christian/phenix-
dev-979/phenix/phenix/refinement/command_line.py", line 97, in run
    call_back_handler=call_back_handler)

  File "/userdata-2/christian/phenix-
dev-979/phenix/phenix/refinement/driver.py", line 1494, in run
    ncs_manager             = self.ncs_manager)

  File "/userdata-2/christian/phenix-
dev-979/phenix/phenix/refinement/strategies.py", line 1046, in 
refinement_machine
    h_params               = h_params)

  File "/userdata-2/christian/phenix-
dev-979/cctbx_project/mmtbx/refinement/adp_refinement.py", line 212, in __init__
    nproc                 = nproc)

  File "/userdata-2/christian/phenix-
dev-979/cctbx_project/mmtbx/refinement/adp_refinement.py", line 389, in __init__
    compute_gradients=False).target_work())



Platform info:
__FILE__ = /net/longnose/scratch2/phenix/phenix-
dev-979/cctbx_project/boost_adaptbx/meta_ext.cpp
__DATE__ = Feb  7 2012
__TIME__ = 02:05:24
__i386__
__linux
__GNUC__ = 3
__GNUC_MINOR__ = 4
__GNUC_PATCHLEVEL__ = 2
boost::python::cxxabi_cxa_demangle_is_broken(): false
__GXX_WEAK__ = 1
__VERSION__ = 3.4.2 20041017 (Red Hat 3.4.2-6.fc3)
FE_INEXACT = 32
FE_DIVBYZERO = 4
FE_UNDERFLOW = 16
FE_OVERFLOW = 8
FE_INVALID = 1
FE_ALL_EXCEPT = 61
BOOST_LIB_VERSION = 1_48
PY_VERSION = 2.7.2
PYTHON_API_VERSION = 1013
sizeof(bool) = 1
sizeof(short) = 2
sizeof(int) = 4
sizeof(long) = 4
sizeof(std::size_t) = 4
sizeof(void*) = 4
sizeof(long long) = 8
sizeof(float) = 4
sizeof(double) = 8
sizeof(long double) = 12
sizeof(boost::int32_t) = 4
sizeof(boost::uint32_t) = 4
sizeof(wchar_t) = 4
__PTRDIFF_TYPE__
Py_USING_UNICODE
sizeof(PY_UNICODE_TYPE) = 2
gnu libc version: 2.10.1
BOOST_ADAPTBX_TYPE_ID_SIZE_T_EQ_UNSIGNED
os.name: posix
sys.platform: linux2
sys.byteorder: little
platform.platform(): Linux-2.6.31-23-generic-pae-i686-with-debian-squeeze-sid
platform.architecture(): ('32bit', 'ELF')
floating_point_exceptions.division_by_zero_trapped: False
floating_point_exceptions.invalid_trapped: False
floating_point_exceptions.overflow_trapped: False
number of processors: 8
Memory total:  25,405,636,608
Memory free:   20,305,633,280
import thread: OK
"hello" = ['h', 'e', 'l', 'l', 'o']
u"hello" = ['h', '\x00', 'e', '\x00', 'l', '\x00', 'l', '\x00', 'o', '\x00']
u"\u00C5" = ['\xc5', '\x00'] as utf-8 = ['\xc3', '\x85']
LATIN CAPITAL LETTER A WITH RING ABOVE = Å