Development Software Chemistry

Development Software Chemistry

Development

Libraries and toolkits for the development of chemical software.

Top: Science: Chemistry: Software: Development

See Also:

- Open source Java computational chemistry package which supports chemical structure drawing and the graphical layout of 2D chemical structures.
- Free library for molecular modeling applications. Written in Python, with a few portions in C. Downloads, examples, documentation, and wiki.
- Free Java computational chemistry library with support for file conversion, SMARTS substructure search, QSAR descriptor calculation, and process/filter methods for molecular data sets.
- Free kit for processing XML+CML in chemistry. Java 1.4 code, XSLT stylesheets, legacy converters and tools. Also includes tools for generating C++, Python and some F90/5 from the schema.
- Software and programming components for Delphi and C++Builder covering mathematics, statistics, scientific graphing, and chemistry.
- Open-source, object oriented cheminformatics framework written in Java.
- Free Perl modules for molecular chemistry. Tutorial, reference manual, downloads and mailing list.
- A distributed client/server system for the computation, management, analysis and visualization of chemical information of any type. Tool collection for several Unix flavors; some of the tools are distributed freely in precompiled form.
- Free Perl module for converting PDB files to VRML for 3D visualization.
- Open-source C++ library for molecule file conversion and pattern matching.
- Free chemoinformatics toolkit geared toward rapid development of chemistry related algorithms. Written in Python with a small portion written in C++.
- A Java based development tool for building portable chemical information systems.
- Free C++ library for converting Protein Data Bank (PDB) files to Virtual Reality Modeling Language (VRML) worlds.

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