Active Tab Application Catalog

Amber PMEMD-parallel is a reimplementation of a subset of sander functionality that has been written with the major goal of improving the performance of the most frequently used methods of sander. Category: Life Sciences

ARMS performs the optimal RMS superposition of two rigid conformers, provided that the pairwise correspondence is known or implicit. Category: Life Sciences

ASV analytical calculation of van der Waals surfaces and volumes. Category: Life Sciences

BLAST finds regions of local similarity between nucleotide or protein sequences. Category: Life Sciences

Blender is an integrated suite of tools enabling the rapid creation of a broad range of 3D content. Category: 3D

CalculiX is a nonlinear three-dimensional finite element program for structural applications. Category: Computer Aided Engineering

CDOSheet allows you to price and risk manage complex deals quickly and easily using built-in, grid-enabled analytics. Category: Financial Services

ClustalW is a fully automatic program for global multiple alignment of DNA and protein sequences. Category: Life Sciences

CSR the Combined SDM/RMS algorithm for spatial alignment of two molecules. Category: Life Sciences

deal.II is a C++ program library targeted at adaptive finite elements and error estimation. Category: Computer Aided Engineering

DOG solves the geometric docking problem for planar and spatial sets. Category: Life Sciences

eHiTS is used for fast, flexible docking of whole or partial structures to target receptors. Category: Life Sciences

ElmerSolver is used for fast, flexible docking of whole or partial structures to target receptors. Category: Computer Aided Engineering

EMBOSS is a free Open Source software analysis package specially developed for the needs of the molecular biology user community. Category: Life Sciences

Enzo is an adaptive mesh refinement (AMR), grid-based hybrid code (hydro + N-Body), which is designed to do simulations of cosmological structure formation. Category: General

FASTA finds regions of local similarity between protein or DNA sequences, either by searching Protein or DNA databases, or by identifying local duplications within a sequence. Category: Life Sciences

fastDNAml is a program for estimating maximum likelihood phylogenetic (evolutionary lines of descent) trees from nucleotide sequences. Category: Life Sciences

FDS is a computer program for modeling fire and smoke flow. Category: General

freeFEM is an open source application based on the finite element method (FEM) for solving partial differential equations (PDE) easily. Category: Computer Aided Engineering

FreeMat is a free environment for rapid engineering and scientific prototyping and data processing. Category: Computational Mathematics

GAMS is specifically designed for modeling linear, nonlinear and mixed integer optimization problems. Category: Computational Mathematics

GAP – Groups, Algorithms, Programming – is a system for computational discrete algebra. Category: Computational Mathematics

GMP is a free library for arbitrary precision arithmetic, operating on signed integers, rational numbers, and floating point numbers. Category: Computational Mathematics

GNU Linear Programming Kit is intended for solving large-scale linear programming (LP), mixed integer programming (MIP), and other related problems. Category: Computational Mathematics

GROMACS is an engine that performs molecular dynamics simulations and energy minimization. Category: Life Sciences

HMMER is a freely distributable implementation of profile HMM software for protein sequence analysis. Category: Life Sciences

Impact is an explicit Finite Element program suite that simulates dynamic impact events. Category: Computer Aided Engineering

MPQC computes properties of atoms and molecules. Category: Life Sciences

NAMD is a parallel, object-oriented molecular dynamics code designed for high-performance simulation of large biomolecular systems. Category: Life Sciences

ngspice is a mixed-level/mixed-signal circuit simulator. Category: General

OFELI is a library of finite element C++ classes for the multipurpose development of finite element software. Category: Computer Aided Engineering

OOFEM is free finite element code with an object-oriented architecture for solving mechanical, transport and fluid mechanics problems. Category: Computer Aided Engineering

ParMETIS implements a variety of algorithms for partitioning unstructured graphs and meshes and for computing fill-reducing orderings of sparse matrices. Category: Computational Mathematics

ParMGridGen is a highly optimized serial and parallel library for obtaining a sequence of successive coarse grids that are well suited for geometric multigrid methods. Category: Computational Mathematics

PETSc is a suite of data structures and routines for the scalable solution of scientific applications modeled by partial differential equations. Category: Life Sciences

POP computes optimal partitions. Category: Life Sciences

Q-Chem is a comprehensive ab initio quantum chemistry package designed for problems of all sizes. Category: Life Sciences

QCM calculates CHI (normalized parity divergence), DSI (whether the set flattens when immersed in higher dimensions) and COR (graph theoretic symmetry elements). Category: Life Sciences

R Project is a language and environment for statistical computing and graphics. Category: Computational Mathematics

Rational Numbers Assign can also be used to assign molecular fragments to a known or proposed compound. Category: Life Sciences

Rational Numbers Partition is a tool for presenting possibilities to a scientist in a visual format and for searching molecular structure databases. Category: Life Sciences

Rational Numbers FragSearch software is designed to assist scientists in identifying small organic compounds from accurate-mass fragmentation data. Category: Life Sciences

Readseq is an open source biosequence conversion library. Category: Life Sciences

SuperLU_DIST is a scalable distributed-memory sparse direct solver for unsymmetric linear systems. Category: Computational Mathematics

T-Coffee is an open source multiple sequence alignment program. Category: Life Sciences

WRF is a next-generation mesocale numerical weather prediction system designed to serve both operational forecasting and atmospheric research needs. Category: General

YafRay is a powerful raytracer, enabling users to create fantastic images and animations of a photorealistic quality. Category: 3D

ZEUS-MP/2 is a computational fluid dynamics code for the simulation of astrophysical phenomena, based on ZEUS-3D and parallelized using the MPI message-passing library. Category: Life Sciences

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