Provided by: cod-tools_2.10+dfsg-1_amd64
NAME
cod_predeposition_check - filter and check pairs of CIF and Fobs files for suitability for deposition to COD database.
SYNOPSIS
cod_predeposition_check --options input.cif input*.cif
DESCRIPTION
Filter and check pairs of CIF and Fobs files for suitability for deposition to COD database.
OPTIONS
-d, --database cod Use database "cod" to query for structures. -h, --host www.crystallography.net -s, --server www.crystallography.net Query COD database on the host 'www.crystallography.net'. -l, --localhost Use database server on the localhost to query the COD database. -p, --port 3306 Use use the specified port (default 3306) to query structures. -t, --table data Use SQL table 'data' to query for structures. -u, --user cod_reader Use user name 'cod_reader' to access COD database; this reader should be granted SELECT privilege, i.e. should be able to read the COD database, without supplying a password. --password Use the specified password (default empty) to connect. --platform 'SQLite' Use the SQL database platform 'SQLite' to query structures (default 'mysql'). --cif input1.cif Specify a CIF file to be deposited. Multiple CIF files can be provided in a way like this: cod_predeposition_check --cif input1.cif --cif input2.cif --hkl, --fobs input1.hkl Specify a Fobs file to be deposited. Multiple Fobs files can be provided in way like this: cod_predeposition_check --hkl input1.hkl --hkl input2.hkl The order of the files is important in order to pair CIF and Fobs files correctly. --type, --deposition-type 'prepublication' Specify the deposition type under which the structure is to be deposited (default 'published'). --author-name 'Doe, J.' Use the specified name as the name of the person depositing the files. --journal 'The Journal' Use the specified journal name as if it was supplied by the depositor during the 'prepublication' type deposition. --hold-period 3 Use the specified hold period as if it was supplied by the depositor. --replace Treat given files as replacements for previously deposited data. --no-replace, --dont-replace Do not treat given files as replacements for previously deposited data (default). --release Treat given files as if they were previously deposited as prepublication material and should now be released into the public domain. --no-release, --dont-release Do not treat given files as if they were previously deposited as prepublication material and should now be released into the public domain (default). --bypass-checks Do not check CIF files for compliance with COD requirements. --dont-bypass-checks, --no-bypass-checks Check CIF files for compliance with COD requirements (default). --split-pdcif Output powder diffraction data blocks as a HKL file. --dont-split-pdcif, --no-split-pdcif Output powder diffraction data blocks as part of the CIF file (default). --print-timestamps Print timestamps to STDOUT at the start and end of each CIF file deposition. --no-print-timestamps, --dont-print-timestamps Do not print timestamps to STDOUT at the start and end of each CIF file deposition (default) --tmp-dir, --temp-dir Use the specified temporary directory (default './'). --use-perl-parser Use Perl parser to parse CIF files. --use-c-parser Use C parser to parse CIF files (default). --help, --usage Output a short usage message (this message) and exit. --version Output version information and exit.
REPORTING BUGS
Report cod_predeposition_check bugs using e-mail: cod-bugs@ibt.lt COD_PREDEPOSITION_CHECK(1)