.TH MOLCIF2SDF 1 .SH NAME molcif2sdf \- convert CIFs with multiple molecules (similar to those obtained from the 'cif_molecule' script) to an SDF file with a molecule description. Intended to be suitable for upload to PubChem. .SH SYNOPSIS molcif2sdf \-\-options < file1.cif molcif2sdf \-\-options file1.cif molcif2sdf \-\-options file1.cif file2*.cif .SH DESCRIPTION Convert CIFs with multiple molecules (similar to those obtained from the 'cif_molecule' script) to an SDF file with a molecule description. Intended to be suitable for upload to PubChem. .SH OPTIONS \-C, \-\-cod\-cif 1000000.cif Provide the original COD CIF to extract structure metadata. \-\-tmp\-dir /tmp Use the specified temporary directory (default: '/tmp'). \-\-help, \-\-usage Output a short help message (this message) and exit. \-\-version Output version information and exit. .SH "REPORTING BUGS" Report molcif2sdf bugs using e\-mail: cod\-bugs@ibt.lt