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Browse free open source Chemistry software and projects below. Use the toggles on the left to filter open source Chemistry software by OS, license, language, programming language, and project status.

  • The most advanced C and C++ source code analyzer Icon
    The most advanced C and C++ source code analyzer

    Combining the benefits of static and dynamic source code analysis to deliver the most advanced & exhaustive code verification tool.

    TrustInSoft Analyzer is a C and C++ source code analyzer powered by formal methods, mathematical & logical reasonings that allow for exhaustive analysis of source code. This analysis can be run without false positives or false negatives, so that every real bug in the code is found. Developers receive several benefits: a user-friendly graphical interface that directs developers to the root cause of bugs, and instant utility to expand the coverage of their existing tests. Unlike traditional source code analysis tools, TrustInSoft’s solution is not only the most comprehensive approach on the market but is also progressive, instantly deployable by developers, even if they lack experience with formal methods, from exhaustive analysis up to a functional proof that the software developed meets specifications.
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  • Create a personalized AI chatbot for each team in minutes Icon
    Create a personalized AI chatbot for each team in minutes

    Get better, faster answers for your whole team with an AI chatbot trained on your company documents.

    QueryPal is the lifeline your team needs. Our AI chatbot integrates seamlessly with your communication channels, using advanced language understanding to identify and auto-answer repetitive questions — in seconds.
    Learn More
  • 1
    Jmol

    Jmol

    An interactive viewer for three-dimensional chemical structures.

    Over 1,000,000 page views per month. Jmol/JSmol is a molecular viewer for 3D chemical structures that runs in four independent modes: an HTML5-only web application utilizing jQuery, a Java applet, a stand-alone Java program (Jmol.jar), and a "headless" server-side component (JmolData.jar). Jmol can read many file types, including PDB, CIF, SDF, MOL, PyMOL PSE files, and Spartan files, as well as output from Gaussian, GAMESS, MOPAC, VASP, CRYSTAL, CASTEP, QuantumEspresso, VMD, and many other quantum chemistry programs. Files can be transferred directly from several databases, including RCSB, EDS, NCI, PubChem, and MaterialsProject. Multiple files can be loaded and compared. A rich scripting language and a well-developed web API allow easy customization of the user interface. Features include interactive animation and linear morphing. Jmol interfaces well with JSpecView for spectroscopy, JSME for 2D->3D conversion, POV-Ray for images, and CAD programs for 3D printing (VRML export).
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    Downloads: 990 This Week
    Last Update:
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  • 2
    FreeLIMS  |  Free LIMS

    FreeLIMS | Free LIMS

    Laboratory Information Management System

    FreeLIMS is a Laboratory Information Management System ( LIMS ). Manage samples; create sample types from methods & parameters; easily generate reports & certificates; fine tune user rights. FreeLIMS is Open Source and Free.
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    Downloads: 77 This Week
    Last Update:
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  • 3
    JSmol

    JSmol

    JavaScript-Based Molecular Viewer From Jmol

    JSmol is the extension of the Java-based molecular visualization applet Jmol (jmol.sourceforge.net) as an HTML5 JavaScript-only web app. It can be used in conjunction with the Java applet to provide an alternative to Java when the platform does not support that (iPhone/iPad) or does not support applets (Android). Used in conjunction with the Jmol JavaScript Object (http://wiki.jmol.org/index.php/Jmol_Javascript_Object), JSmol seamlessly offers alternatives to Java on these non-Applet platforms. JSmol can read all the files that Jmol reads. You can do all the scripting that Jmol does. You can create all the buttons and links and such that you are used to creating for Jmol. All of the rendering capability of the Jmol applet is there. JSmol has both a console and a popup menu. JSmol is integrated fully with JSME and JSpecView. A "lite" version of JSmol provides minimal functionality (balls and sticks only) for extremely small-bandwith apps. Released 1/12/2013
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    Downloads: 20 This Week
    Last Update:
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