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Re: Version 0.9.0 sent to COMCIFS for review ....

Jiansheng Jiang (jiang@bach.pdb.bnl.gov)
Thu, 30 Jan 1997 22:21:32 -0500 

John,

I just found the differences between us are:

>  _phasing_MIR_refln.der_id   . . . . . . . . . . . . . .    74
>  _phasing_MIR_refln.F_calc   . . . . . . . . . . . . . .    79
>  _phasing_MIR_refln.F_calc_au  . . . . . . . . . . . . .    85
>  _phasing_MIR_refln.F_meas   . . . . . . . . . . . . . .    91    99   104
>  _phasing_MIR_refln.F_meas_au  . . . . . . . . . . . . .    95
>  _phasing_MIR_refln.F_meas_sigma   . . . . . . . . . . .    98
>  _phasing_MIR_refln.F_meas_sigma_au  . . . . . . . . . .   103
>  _phasing_MIR_refln.index_h  . . . . . . . . . . . . . .   108
>  _phasing_MIR_refln.index_k  . . . . . . . . . . . . . .   112
>  _phasing_MIR_refln.index_l  . . . . . . . . . . . . . .   116
>  _phasing_MIR_refln.phase_calc   . . . . . . . . . . . .   120

###########################
## PHASING_MIR_DER_REFLN ##
###########################

save_PHASING_MIR_DER_REFLN
    _category.description
;              Data items in the PHASING_MIR_DER_REFLN category record details
               about the calculated structure factors obtained in an MIR
               phasing experiment.

               This list may contain information from a number of different
               derivatives; _phasing_MIR_der_refln.der_id indicates to which
               derivative a given record corresponds. (A derivative in this
               context does not necessary equate with a data set; see the
               definition of the PHASING_MIR_DER dategory for a more
               thorough discussion of the meaning of derivative.)

               It is not necessary for the data items describing the measured
               value of F to appear in this list, as they will already have
               been given in the PHASING_SET_REFLN category. However, these
               items may also be listed here for completeness, if desired.
;
    _category.id                  phasing_MIR_der_refln
    _category.mandatory_code      no
     loop_
    _category_key.name          '_phasing_MIR_der_refln.index_h'
                                '_phasing_MIR_der_refln.index_k'
                                '_phasing_MIR_der_refln.index_l'
                                '_phasing_MIR_der_refln.der_id'
                                '_phasing_MIR_der_refln.set_id'
     loop_
    _category_group.id           'inclusive_group'
                                 'phasing_group'
     loop_
    _category_examples.detail
    _category_examples.case
#

-- 
====================================================================
Jiansheng Jiang Ph.D.          | 
Protein Data Bank              | Phone: (516) 344-6388            
Biology Department, Bldg 463   | Fax:   (516) 344-5751
Brookhaven National Laboratory | mailto://jiang@bnl.gov
Upton NY 11973-5000, USA       | http://www.pdb.bnl.gov/~jiang  
====================================================================