Download Chemistry & physics scripts

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336 336

It even supports parallel computing, being implemented in its main modules.

C & c++ | Sep 11, 2010 | downloaded 8 script(s) | N/A

EMAN is a suite of scientific image processing tools aimed primarily at the transmission electron microscopy community, though it is beginning to be used in other fields as well. EMAN has a particular focus on performing a task known as single ...

C & c++ | Sep 12, 2010 | downloaded 1 script(s) | N/A

Most important functions of Meep:

C & c++ | Sep 13, 2010 | downloaded 2 script(s) | N/A

This program is written using C++ and the Qt4 GUI.

C & c++ | Sep 13, 2010 | downloaded 3 script(s) | N/A

KMol is a molecular weight and elemental composition calculator.

C & c++ | Sep 13, 2010 | downloaded 3 script(s) | N/A

- Compute energy and gradient using :

C & c++ | Sep 13, 2010 | downloaded 3 script(s) | N/A

- Fixed length, fixed angle drawing.

C & c++ | Sep 13, 2010 | downloaded 2 script(s) | N/A

- GROMACS can be run in parallel, using standard MPI communication.

C & c++ | Sep 13, 2010 | downloaded 3 script(s) | N/A

That means that Open Babel has two main pieces:

C & c++ | Sep 13, 2010 | downloaded 1 script(s) | N/A

This package allows you to construct, view and analyse atomic structures.

C & c++ | Sep 13, 2010 | downloaded 4 script(s) | N/A

- Support for many common file formats (eg CIF, PDB, XTL, XYZ).

C & c++ | Sep 13, 2010 | downloaded 1 script(s) | N/A

Chemtool is a program for drawing organic molecules. It runs under the X Window System using the GTK widget set.
Most operations in chemtool can be accomplished using the mouse - the first (usually the left) button is used to select or ...

C & c++ | Sep 14, 2010 | downloaded 4 script(s) | N/A

Fityk is a program for nonlinear fitting of analytical functions (especially peak-shaped) to data (usually experimental data). There are also people using it to remove the baseline from data, or to display data only.
It is reportedly ...

C & c++ | Sep 14, 2010 | downloaded 7 script(s) | N/A

This tool can be used for physics or chemistry applications or various studies.

C & c++ | Sep 14, 2010 | downloaded 3 script(s) | N/A

gdpc is a program for visualising molecular dynamic simulations. It is a very versatile program and could easily be used for any other purposes.
gdpc reads xyz input and custom formats and can write out pictures of the ...

C & c++ | Sep 14, 2010 | downloaded 2 script(s) | N/A

GenChemLab is an OpenGL-based application intended to simulate several common general chemistry exercises. It is meant to be used to help students prepare for actual lab experience.
It could also be used in cases where laboratory ...

C & c++ | Sep 14, 2010 | downloaded 5 script(s) | N/A

Xem Application allows you to solve pH balance equations.

C & c++ | Sep 15, 2010 | downloaded 1 script(s) | N/A

- Animating multiple frame files

C & c++ | Sep 15, 2010 | downloaded 3 script(s) | N/A

This program computes, for a nucleic acid duplex, the enthalpy, the entropy and the melting temperature of the helix-coil transitions. Three types of hybridisation are possible: DNA/DNA, DNA/RNA, and RNA/RNA.
The program first computes ...

C & c++ | Sep 15, 2010 | downloaded 3 script(s) | N/A

- gElemental supports multiple languages.

C & c++ | Sep 16, 2010 | downloaded 2 script(s) | N/A

A ray tracer calculates the direction of thousands of beams of light. It gathers information and illuminates the surface accordingly.
This raytracer accepts commands from a text file and generates a output file. Another programs reads ...

C & c++ | Sep 16, 2010 | downloaded 3 script(s) | N/A

- engineering properties like Ex, Ey, Gxy

C & c++ | Sep 16, 2010 | downloaded 2 script(s) | N/A

All the used entities are encapsulated in the object form.

C & c++ | Sep 16, 2010 | downloaded 1 script(s) | N/A

and (partially) ADF calculation results, including the following:

C & c++ | Sep 16, 2010 | downloaded 10 script(s) | N/A

It has advanced joint types and integrated collision detection with friction.

C & c++ | Jan 22, 2011 | downloaded 2 script(s) | N/A

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