From 835e58d7007f3c3ea23952fb3c7ee1aed57468c3 Mon Sep 17 00:00:00 2001 From: Juergen Haas <juergen.haas@unibas.ch> Date: Wed, 27 Jun 2012 18:50:20 +0200 Subject: [PATCH] adding documentation for chemlib_info table in compound library --- modules/conop/doc/compoundlib.rst | 20 ++++++++++++++++++++ 1 file changed, 20 insertions(+) diff --git a/modules/conop/doc/compoundlib.rst b/modules/conop/doc/compoundlib.rst index 48ee192df..3e0e70d41 100644 --- a/modules/conop/doc/compoundlib.rst +++ b/modules/conop/doc/compoundlib.rst @@ -62,6 +62,26 @@ build the compound library manually. Clear the compound cache. + .. method:: SetChemLibInfo() + + When creating the new library the current date and the Version of OST used + are stored into the table chemlib_info. + + .. method:: GetOSTVersionUsed() + + reads out ost_version_used from the table chemlib_info. + + :returns: a version string + + :rtype: :class:`String` + + .. method:: GetCreationDate() + + reads out creation_date from the table chemlib_info. + + :returns: a date string (Py), a Date (C++) + + :rtype: :class:`String` (Py), :class:`Date` .. class:: Compound Holds the description of a chemical compound, such as three-letter-code, and -- GitLab