Molecular modelling,drawing, molecular mechanics, Semi-empirical calculations, structure display |
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Version 10 Modules
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ChemSite
3D Molecular Visualization Software Download and use now |
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Modeling Features: Molecular models may be constructed in a variety of ways. A sketching tool is provided with automatic 2D to 3D conversion for easy building of inorganic and organic molecules. Organic molecules may be built from common organic functional groups and fragments. Peptides and proteins may be built with both D and L amino acids. Single and double stranded DNA/RNA polynucleotides may be constructed with ease. Visualization Features: Models may be viewed as stick figures, balls and sticks, CPK or with polymers as ribbons or extrusions. With stick figures, molecular models may be rotated in real time with the mouse. The program features ray tracing and texture mapping for the utmost in molecular graphics realism. Rendering styles may be mixed as desired. With high resolution displays, photo realistic display of molecular models are easily created. Images may be printed, saved as .BMP or TARGA files, or exported through the clipboard to word processors and desktop publishing programs. ChemSite brings state of the art workstation quality graphics capabilities to the pc. Molecular Mechanics: Features ChemSite performs energy minimization and molecular dynamics simulation. Available force fields include Amber, mm2 and the ChemSite's default cm+ force field for accurate calculations with almost any molecule. The program performs real time animation of energy minimization and molecular dynamics simulation with small to medium size molecules. With large molecules such as proteins, movies of molecular dynamics simulations may be recorded to disk and played back for real time animation. Supported File Formats: ChemSite reads and writes the following file formats: ChemSite library (.lib) ChemSite system (.syc) Brookhaven Protein databank (.ent and .pdb) MDL mol file (.mol) Mopac Z-matrix (.zmt, .mop) Connectivity table (.ct) Cartesion A (.cta) Your ChemSite package includes: Single user license and software package Comprehensive illustrated instruction manual Extensive library of organic & biological molecules |