Molecular Modeling Basic^TM

Draw in 3-D structures with a mouse; display, clip and rotate them as wire frames, ball and sticks, shaded spheres and dot surfaces. Display up to 40 molecules and 4000 atoms. Color by atom type, residue, charge or lipophilicity. Includes a minimizer (2 methods), conformational analysis of 1 or 2 rotating bonds and Huckel, CNDO and INDO semi-empirical quantum mechanics. Inputs and outputs MDL Molfiles, MacroModel files and MOPAC files, inputs Brookhaven pdb files and supports copy and paste of graphics to other WINDOWS programs. Supports all WINDOWS printers. Calculates molecular weight, volume, surface area, dipole moment, and mass percent. This program comes with the booklet An Introduction to Molecular Modeling and on-line help. (Requires Windows 3.1, 95 or NT)

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