What does chemoinformatics include?

MOE (Molecular Operating Environment):

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  Source: MOE is a commercial software package that offers molecular docking as one of its many features. You can obtain a license and access MOE from the Chemical Computing Group (CCG) website: CCG MOE
  

Schrodinger Suite:

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  Source: Schrödinger offers a suite of computational chemistry software, including Glide, which is a popular molecular docking tool. You can inquire about licensing and access on the Schrödinger website: Schrödinger
  

DOCK:

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  Source: DOCK (the UCSF Docking Program) is an open-source molecular docking software developed by the Shoichet Laboratory at the University of California, San Francisco. You can find more information and access DOCK on their website: UCSF DOCK
  

Please note that while some of these programs are open-source and freely available, others are commercial software that may require a license or subscription. Additionally, the choice of molecular docking software often depends on the specific needs of your research, the nature of the molecules you are studying, and your familiarity with the software's capabilities. It's also a good practice to consult with experts in the field and refer to the documentation and tutorials provided by the software developers to ensure effective usage.

What are the best free programs for molecular docking and show the source

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As of my last knowledge update in September 2021, several free molecular docking programs were widely used in the field of computational chemistry and drug discovery. These programs are open-source and freely available for academic and research purposes. Please keep in mind that the availability and features of software tools can change over time, so it's essential to check the official sources and documentation for the most up-to-date information. Here are some of the best free programs for molecular docking and their official sources:

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