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JChemPaint 2.3.0

JChemPaint 2.3.0


JChemPaint is a 2D molecular structure editor. more>>
JChemPaint project is an editor for 2D molecular structures.
JChemPaint is intended to be complementary to Jmol, a visualisation and analysis tool for 3D molecular structures, started by Dan Gezelter at Notre Dame University, initator of the Open Science Project. and, like JChemPaint, developed by an international team of opensource programmers.
Main features:
- JChemPaint is open source OS. It is Free Software. We believe that scientific software, especially when its development was publically funded, should be free. As the GNU people put it: "``Free software is a matter of liberty, not price. To understand the concept, you should think of free speech, not free beer. ". Everyone can participate in the development of the program. Everyone can download and change the source code, provided that he makes the changes publicly available again, according to the GNU Lesser General Public License, LGPL. This ensures that the community can take advantage of any bugfix/enhancement made to the system.
- It also ensures that a scientist, who needs a standard piece of software like a structure editor as a helper application in her new program, does not have to reinvent the wheel over and over again because all the structure editors that have been written before are now proprietory software. If there is a free structure editor, she can focus on the real science.
- JChemPaint is not complete :-). Honestly, it can still use a lot of development (see below).
- Since JChemPaint is written in Java it runs on any computing platform and operating system for which a Java Virtual Machine (of version >= 2) has been implemented (like Linux, Windows 95/98/NT, Solaris, AIX and others).
- JChemPaint is avaiblable free of charge.
- JChemPaint is translated into several languages: Dutch, French, German and Polish.
Enhancements:
- This release is a build from the latest of CDK SVN.
- It adds InChI support and a SMILES entering field with memory.
- Many bugs were fixed, and the program should be faster too.
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Added: 2006-09-23 License: LGPL (GNU Lesser General Public License) Price:
1127 downloads
Chemistry Development Kit 1.0.1

Chemistry Development Kit 1.0.1


Chemistry Development Kit is a Java classes for chemo- and bioinformatics. more>>
Chemistry Development Kit classes are Java utitility classes for ChemoInformatics and Computational chemistry, written in Java. They are developed constantly developed parallel to other projects that make use of them.
They are a complete re-write of the CompChem classes that were the basis of JChemPaint, a Java Editor for 2D chemical structures, and of JMDraw, a Java package for the graphical layout of 2D chemical structures.
The CDK project was started in September 2000 to replace the CompChem libraries used by JChemPaint, Jmol and SENECA. It no longer is in its initial stage, but is slowly getting a solid state.
The people involved in setting up the project are Christoph Steinbeck then at the Chemoinformatics Group at the Max Planck Institute of Chemical Ecology in Jena, as well as Egon Willighagen from the University of Nijmegen, The Netherlands, who is also involved with JChemPaint and many other Java Chemoinformatics programs, and Dan Gezelter from Notre Dame University, South Bend, USA, the initiator of Jmol, a 3D viewer and analyzer for molecules .
Now, the rewrite of these CompChem/CDK library classes do somehow effect all of our projects. All of our code relies to some extend on the so-called CompChem classes for computational chemistry.
Christoph Steinbeck started this chemistry library when he started programming SENECA, a system for Computer Assisted Structure Elucidation. It turned out that some of the code had design flaws that prevented others, like the authors of (Jmol) to use it.
Enhancements:
- This release consists of mostly some bugfixes, but also solves a few Java 1.4.2 compile problems and adds more functionality to the SMARTS parser.
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Added: 2007-06-26 License: LGPL (GNU Lesser General Public License) Price:
851 downloads
Bioclipse 1.0.1 / 1.1.3 Beta

Bioclipse 1.0.1 / 1.1.3 Beta


Bioclipse is a rich-client platform chemistry and biology workbench. more>>
Bioclipse is a rich-client platform chemistry and biology workbench. Bioclipse provides access to many open source bioinformatics and chemoinformatics toolkits and has plugins for the Chemistry Development Kit, JChemPaint, Jmol, and BioJava.

General:

Based on Eclipse
Platform independent
Automated update via plugin server

Supported entities:

small molecules
proteins
RNA
DNA
sequences
alignments

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Download (48MB)
Added: 2007-06-21 License: Eclipse Public License Price:
860 downloads

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