================= 96/10/08 =================== "Dr. Jorge Seminario" Subject: CCL:ACS Symposium on DFT (San Francisco) "Ananikov V.P." Subject: CCL:SUMMARY: MOL to HPGL conversion Pablo Vitoria Garcia Subject: CCL:Information about G94 basis for transition metals coordination compounds Pablo Vitoria Garcia Subject: CCL:G94 Methods and basis for coordination compounds From: gadre@cdac.ernet.in From: Subject: CCL:Virial theorem... From: underhil@hp.rmc.ca (Ross Underhill) Subject: CCL:IR freeware From: Subject: CCL:GAMESS:partial geometry optimization From: qibvigap@lgdx02.lg.ehu.es (Pablo Vitoria) Subject: CCL:Error message in AIM calculation in G94 From: Jeffrey J Ayres Subject: CCL:Re:PDB format From: Shubin Liu Subject: CCL:How to extract Ex and J values in G94 HF calculation? From: "Irina K. Vorontsova" Subject: CCL:Heats of adsorption of simple molecules From: "Hr. Dr. S. Shapiro" Subject: CCL:Calc'n of delta G of solvation From: Dongchul Lim Subject: CCL:Gaussian cube visualization Jeffrey.Nauss@UC.Edu (Jeffrey L. Nauss) Subject: CCL:Discover to AMBER trajectory conversion Jeffrey.Nauss@UC.Edu (Jeffrey L. Nauss) Subject: CCL:Recommended reference for DELPHI Guy DESMARQUETS <101626.1574@CompuServe.COM> Subject: CCL:Biomolecules visualisation PC Soft "Marek J. Smolinski" Subject: CCL:Frequencies of the molecules in a crystal ferenc@rchsg8.chemie.uni-regensburg.de (Ferenc Molnar) Subject: CCL:halomethanes dgregory@msi.com (Don Gregory) Subject: CCL:Recommended reference for DELPHI Vladimir Gusev Subject: CCL:Characterization of Porous Materials: from Angstroms to Millimeters Dale Young Subject: CCL:Periodic Table for Windows 95