Video Tutorials

Summary of Video Tutorials | 视频教程总结

A Quick Introduction | 用于构建镧系元素配合物的软件快速介绍

Easy Start Guide | 简单的入门指南

Requesting a Free License Key
- To obtain a free license, simply install and run the software.
  On the top left corner of the Complex Build window, you will see a series of buttons, including the “Request a license” button with the white key icon, as shown below.
  
  Click on it, and follow the instructions.
  Promptly, you should receive an e-mail with a six character code.
  Now, click on the “Validate the license” button with the black key icon, and enter the six character code.
  
  That is it. Enjoy!
  Warning:
  Unfortunately, sometimes, when the free license is requested, or when the form is filled, nothing happens.
  Something, probably a firewall, is blocking communication with our server.
  In this case, please send us an e-mail to complexbuildsoftware@gmail.com requesting a free one-year license. We will happily send you a reply with the requested free license, as attached files, within a couple of days. In the meantime, please enjoy your 7-day trial.

Selecting a Set of Ligands to Build the Complex | 选择一组配体以构建综合体
- Denticity Choice
- Select Ligands one-by-one
  - By the Short Identifier
  - By the Molecular Formula
  - By the Name
  - By the Charge
  - By a Combination of Options
  - Viewing Ligand
  - How to Add a New Ligand to the Complex
  - Removing Ligands from the List of Selected Ligands

Favorites | 如何将配体添加到最喜欢的配体列表中
- Creating a List of Favorite Ligands
- Removing a Ligand from the List of Favorites
- Displaying the List of Favorite Ligands

How to Add a New Ligand to the Database | 如何将新配体添加到数据库
- Managing the Database
- Renaming the Short Identifier
- Removing a Ligand from the Database
- Reseting the Database

Saving Computational Chemistry Input Files
- For Only One Stereoisomer
  - Specifying a Mopac Lanthanide Model
- For a Set of Stereoisomers
  - Specifying Point Groups
  - Specifying the Computational Chemistry Input File Type
  - Changing the Ligands Abbreviation

Opening a Computational Chemistry Input File

Saving a Session

Loading a Session

Appearance
- Rotating the Structure
- Zooming the Structure In and Out
- Resizing Atoms
- Hiding Hydrogens Atoms Bound to Carbon in Organic Ligands
- Changing the Molecular Graphic Representation
- Changing the Background Color
- Displaying the Complex Elliptic Envelope
- Displaying the Coordination Polyhedron Elliptic Envelope
- Displaying a Coordinating Bond Lenght
- Switching between Enantiomers
- Saving an Image of the Stereoisomer

The Complex Build Algorithm | 构建镧系元素配合物的算法
- Ligand Degrees of Freedom
- Hinge Angles
  - Orientation
  - Distance
  - Placement
  - Shape
- Geometry Optimization
  - Minimizing
    - Coordination Warp
    - Steric Congestion
    - Crowding
  - Stopping Optimization
  - Reoptimizing Structure
- Parameters for Geometry Optimization
  - Hinge Angles Only. Orientation, Distances, Placement, and Shape Choice are Conserved
  - Orientation and Distances Only. Placement and Shape Choice are Conserved
  - Orientation and Placement. Shape Choice is Conserved
  - Orientation and Placement. Shape Choice is Conserved. Global Minimum Search
    - Select a Shape
      - Ligand Placement Default
        Select a Point Group
        Select a Specific Permutation
      - Choosing the Ligands' Placements
        Placing a Monodentate Ligand
        Placing a Bidentate Ligand
        Binding a Ligand
        Autobinding Ligands
        Reseting the Ligands' Placements
  - Orientation, Placement, and Shape
  - Orientation, Placement, and shape. Global minimum search

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