From chemistry-request(+ at +)server.ccl.net Wed Nov 1 01:27:05 2000 Received: from dns2.seanet.com (dns2.seanet.com [199.181.164.2]) by server.ccl.net (8.8.7/8.8.7) with ESMTP id BAA28400 for ; Wed, 1 Nov 2000 01:27:05 -0500 Received: from biggeek (dialup-63.214.12.53.Seattle1.Level3.net [63.214.12.53]) by dns2.seanet.com (8.9.3/8.9.0) with SMTP id WAA02960; Tue, 31 Oct 2000 22:26:13 -0800 (PST) Message-ID: <008d01c043cc$c350dda0$01808080 /at\biggeek> From: "Mark A. Thompson" To: chemistry # - at - # server.ccl.net Cc: Subject: ArgusLab 2.0: beta2 released Date: Tue, 31 Oct 2000 22:27:00 -0800 ArgusLab 2.0 beta2 is available for download. http://www.seanet.com/~mthompson/ArgusLab Changes from beta1 include: -------------------------------- 1. different install program: fixed a lot of complaints. 2. 800x600 pixel support for those who did not have the higher screen resolutions. 3. minor bug fixes. 4. more fragments added to fragment library. ArgusLab is a molecular modeling program for Microsoft Windows operating systems. Overview of 2.0 features: ----------------------------- 1. Interactive 3D Molecule Builder with: Interactive 3D manipulator Fragment Library Beautify Geometry Automatically Add/Hide/Delete Hydrogens Cut & Paste Supports Multiple-Level Undo/Redo. Multiple Rendering Styles for Atoms and Bonds Geometry Monitors 2. Calculation Types Single-Point Energies Optimize Geometries Electronic Excitation Spectra Self Consistent Reaction Field (SCRF) Solvent Model for Electronic Spectra 3. Molecular Mechanics Universal Force Field (UFF) for the entire periodic table 4. Quantum Mechanics Extended Huckel for entire periodic table MNDO, AM1, and PM3 semi-empirical Hamiltonians INDO1/s semi-empirical Hamiltonian Restricted and Unrestricted Hartree-Fock SCF 5. File Types: supports XYZ, PDB, and ArgusLab XML file formats. 6. HTML Help 7. No size limitations for molecules or calculations other than = available system resources 8. Multi-threaded architecture allows multiple molecules opened = simultaneously and running calculations 9. Runs on Windows 95/98, Windows NT 4.0, Windows 2000