Named Chemical Reactions

Tao::DBI::st is a Perl module for DBI statements with portable support for named placeholders. SYNOPSIS use Tao::DBI qw(dbi_connect dbi_prepare); $dbh = dbi_connect($args); $sql = q{UPDATE T set a = :a, b = :b where k = :k}; $stmt = $dbh->prepare($sql); $rc = $stmt->execute({ k => $k, a...

Class::ParmList is a Perl module with methods for processing named parameter lists. SYNOPSIS use Class::ParmList qw(simple_parms parse_parms); $thingy->some_method({ -bgcolor => #ff0000, -textcolor => #000000 }); sub some_method { my ($self) = shift; my ($parm_ref) = @_; my $parms...

The world of Darwinia is a virtual themepark, running inside a computer network built by a computer genius named Dr Sepulveda. Darwinia is populated by a sentient evolving life form called the Darwinians. They are the product of a decades worth of research into genetic algorithms..


Platforms: *nix

MathML::Entities is a Perl module that can convert XHTML+MathML Named Entities to Numeric Character References. SYNOPSIS use MathML::Entities; $html = © by me; # convert named HTML entities to character references: $numeric = name2numbered($html); # © by me # convert named HTML...


Platforms: *nix

Opcode is a Perl module created to disable named opcodes when compiling perl code. SYNOPSIS use Opcode; Perl code is always compiled into an internal format before execution. Evaluating perl code (e.g. via "eval" or "do file") causes the code to be compiled into an internal format and...


Platforms: *nix

Berusky application is a logic game that is based on an ancient puzzle named Sokoban. An old idea of moving boxes in a maze has been expanded with new logic items such as explosives, stones, special gates and so on. In addition, up to five bugs can cooperate and be controlled by the player. In...


Platforms: *nix

XMMS InfoPipe is a plugin that reports XMMS status via named pipe. XMMS InfoPipe is handy if you want to add interesting real-time information for a personal web page, or a web cam page. While theres a possibility of setting up programs to be executed by XMMS when changing songs, XMMS InfoPipe...


Platforms: *nix

Nomen project is a tool which creates chemical structures from valid IUPAC names. It outputs a 2D view and (optionally) a CML file..


Platforms: *nix

DWSIM is a Chemical Process Simulator for Windows, Linux and Mac. Built for the Microsoft .NET 2.0 and Mono Platforms and featuring a rich Graphical User Interface (GUI), DWSIM allows chemical engineering students and chemical engineers to better understand the behavior of their chemical systems...


Platforms: Mac

Jmol is an applet and Java based application designed to display various 3D chemical information. Jmol's features include reading a variety of file types and output from quantum chemistry programs, and animation of multi-frame files and computed normal modes from quantum programs....


Platforms: Windows

SketchEl is an interactive chemical molecule sketching tool, and molecular spreadsheet data entry application. The feature set provided by the molecular sketcher is largely limited to the minimum features required to conveniently edit diagram representations of small molecule structures....


Platforms: Windows

The DynaFit application was developed to perform nonlinear least-squares regression of chemical kinetic, enzyme kinetic, or ligand-receptor binding data. The experimental data can be either initial reaction velocities in dependence on the concentration of varied species (e.g., inhibitor...


Platforms: Windows

ChemDoodle is a fully functional chemical drawing application that works on every operating system! In addition to being multiplatform, ChemDoodle also natively reads and writes many common file formats including ChemDraw's CDX and CDXML. You can write ChemDraw files for submitting journal...


Platforms: Windows

ChemDoodle is a fully functional chemical drawing application that works on every operating system! In addition to being multiplatform, ChemDoodle also natively reads and writes many common file formats including ChemDraw's CDX and CDXML. You can write ChemDraw files for submitting journal...


Platforms: Linux

ChemDoodle is a fully functional chemical drawing application that works on every operating system! In addition to being multiplatform, ChemDoodle also natively reads and writes many common file formats including ChemDraw's CDX and CDXML. You can write ChemDraw files for submitting journal...


Platforms: Mac

AMBIT offers chemoinformatics functionality via REST web services and desktop applications. Chemical compounds and data storage in MySQL database; substructure, similarity and other queries, descriptor calculation and predictive models building.


Platforms: Windows, Mac, Linux

Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas. * Ready-to-use...


Platforms: Windows, Mac, *nix, C/C++, BSD

This script takes a series of known named checkboxes and checks or uncheck them all at once.It can even change each checkbox to the opposite checked or not checked value.


Platforms: JavaScript

The five programs provided solve several process design problems. These examples were originally provided as applications of process design optimization by Edgar, Himmelblau and Lasdon in their excellent book entitled Optimization of Chemical Processes, McGraw-Hill International Edition, 2001....


Platforms: Matlab

We use the SRK equation of state to compute the correction factor due to gas-phase nonideality as a result of the high pressure applied in the ammonia synthesis. We also compute the extent of reaction. Plots of these two quantities versus pressure for temperature equal to 800K are presented. The...


Platforms: Matlab