From: Joerg K. W. <we...@in...> - 2004-03-23 19:49:40
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Hi all, here is the proposed CML2 bugfix release. BTW, i've added: -Amber prep -Mopac out And fixed: - Reading Sybyl partial charges are now not overwritten by JOELib' partial charges, so you can store these infromations now in CML2. All partial charges in CML2 contain now a vendor information. Kind release regards, J=F6rg --=20 Dipl. Chem. Joerg K. Wegner Center of Bioinformatics Tuebingen (ZBIT) Department of Computer Architecture Univ. Tuebingen, Sand 1, D-72076 Tuebingen, Germany Phone: (+49/0) 7071 29 78970 Fax: (+49/0) 7071 29 5091 E-Mail: mailto:we...@in... WWW: http://www-ra.informatik.uni-tuebingen.de -- Never mistake motion for action. (E. Hemingway) Never mistake action for meaningful action. (Hugo Kubinyi,2004) |