Dear Pascal, Thank you for your time and helpful comments !
After some digging about static-linking openbabel 2.2.3, it seems that providing options to cmake is not enough. The “formats” is not included in libopenbabel.a. The CMakeList.txt has changed a lot from 2.2.3 to 2.3.2 O_O In fact, the whole set of “formats” cannot be included because there are multiple xml.o (with the same name). In the end, I just linked the object files for the xyz and smi formats and get a “minimum” static version that works ... I also hope for the bug to be corrected soon. Many thanks again ! Best wishes, Jiaguo From: Pascal Muller-3 [via Open Babel] Sent: Thursday, May 15, 2014 3:46 PM To: Jiaguo Subject: Re: The SMILES of Hip (protonated Histine) is wrong ? Hi, Could you help to comment on how to obtain OpenBabel v2.2.3 binaries on the latest CentOS 5 and 6 ? I compiled v2.2.3 like the latest version - or, well, following the INSTALL file instructions (scientific linux 6.1). The compilation steps changed somewhere between the release (i.e. make, and not yet cmake, for 2.2.3)... It would be great if you would comment on the procedure how to get a full static build on linux for the v2.2.3 version ! I mean, the “static build” options appeard after 2010, while v2.2.3 was from 2009. http://ehc.ac/p/openbabel/mailman/message/26441509/ http://openbabel.org/wiki/CMake#Static_builds Sorry, for the static build option, I don't know, I never used it. But the bug (if there is really one) correction may be quick - if someone competent has time for it. I think it will be much better to go for the last version. Best, Pascal ------------------------------------------------------------------------------ "Accelerate Dev Cycles with Automated Cross-Browser Testing - For FREE Instantly run your Selenium tests across 300+ browser/OS combos. Get unparalleled scalability from the best Selenium testing platform available Simple to use. Nothing to install. Get started now for free." http://p.sf.net/sfu/SauceLabs _______________________________________________ OpenBabel-discuss mailing list [hidden email] https://lists.sourceforge.net/lists/listinfo/openbabel-discuss -------------------------------------------------------------------------------- If you reply to this email, your message will be added to the discussion below: http://forums.openbabel.org/The-SMILES-of-Hip-protonated-Histine-is-wrong-tp4657433p4657439.html To unsubscribe from The SMILES of Hip (protonated Histine) is wrong ?, click here. NAML -- View this message in context: http://forums.openbabel.org/The-SMILES-of-Hip-protonated-Histine-is-wrong-tp4657433p4657440.html Sent from the General discussion mailing list archive at Nabble.com. ------------------------------------------------------------------------------ "Accelerate Dev Cycles with Automated Cross-Browser Testing - For FREE Instantly run your Selenium tests across 300+ browser/OS combos. Get unparalleled scalability from the best Selenium testing platform available Simple to use. Nothing to install. Get started now for free." http://p.sf.net/sfu/SauceLabs _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss