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ArgusLab

molecular modeling, graphics and drug design program

Description

molecular modeling, graphics, design and drug program "
zagruzit.com Editor: What's New


ArgusDock 4.0.1 's in: the new drug code placement. Placing a pre-set parameters AScore engines and scoring functions include both GADock and ArgusDock. Help for protein staining with a variety of options docking tutorials / Tutorials menu option read.


Ribbon rendering: Be.


Solvent accessible surfaces


Ligand and protein targets and screen blow


Gauss 98 & Gaussian 03 interfaces: easily set up and run a local Windows PC Gauss calculations, hydrogen bonds between the tracks. Output, etc. will be added to the calculation results in automatic Molecule Treeview for land surfaces. ArgusLab as effective as it'll be considered a part of the Gauss ArgusLab own calculation has completed. You can also save the generated input files Gauss ArgusLab to work offline or on another machine.


Molecule Treeview window: Molecule Treeview molecule displays a treeview representation of calculation results and saves you run with. Select the features you many accounts, and right-click "or" on the screen to see the animation render. Can handle large complex systems easier TreeView. For example, by selecting a protein activated by selecting specific residues or residues.


Builder Toolkit window: This window and the cursor and where you can add the amino acid molecules, atoms, rings of the palette shows the homo, LUMO for the window.


Buttons, and ESP-density mapped QuickPlot surfaces. One click and all the necessary calculations and can be made for surface preparation and surface screen is displayed.


Query PDB database: download and display PDB files with a single click.


Molecular calculation results and properties are saved Treeview:


Copy / Paste or features calculation results


ZINDO Enhancements


Electric Field: SCF and CI, EHT, AM1, PM3, MNDO, ZINDO


Display XYZ Cartesian axes.
You can now download free ArgusLab 4.0.1.

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