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AMD Core Math Library for x86 and amd64 CPUs

Library to order a sparse matrix prior to Cholesky factorization

Data structures and algorithms for both exact and approximate nearest neighbor searching in arbitrarily high dimensions.

Arnoldi package library to solve large scale eigenvalue problems.

Arbitrary precision float arithmetics and functions

The database for the BALBES automated crystallographic molecular replacement pipeline

DFT electronic structure code using a wavelet basis set

Automatically Tuned Linear Algebra Software BLAS implementation

Fast implementations of the Basic Linear Algebra Subroutines

Basic Linear Algebra Subprograms F77 reference implementations

Algorithm for matrix permutation into block triangular form

BuDDY - A Binary Decision Diagram Package

A Free Software Three-Dimensional Structural Finite Element Program

A Free Software Three-Dimensional Structural Finite Element Program

Library to order a sparse matrix prior to Cholesky factorization

CandyStore is a post processor for CalculiX

An Object-Oriented Software for Reacting Flows.

Library providing a simple mechanism for accessing CBF files and imgCIF files.

cblas-reference

C wrapper interface to the F77 reference BLAS implementation

C++ interface for cfitsio

Constrained column approximate minimum degree ordering algorithm

Protein X-ray crystallography toolkit

Computational Crystallography Toolbox

Another implementation of the double description method

C implementation of the Double Description Method of Motzkin et al.

Common Data Format I/O library for multi-dimensional data sets

C and Fortran library for manipulating FITS files

cgnsfoam is a conversion tool from cgns to openfoam format

The CFD General Notation System (CGNS) is a standard for CFD data.

The CFD General Notation System (CGNS) tools.

A set of C functions that generate PostScript for publication quality scientific plots

Sparse Cholesky factorization and update/downdate library

Provides an object-oriented application interface to information in mmCIF format

f2c'ed version of LAPACK

Object-oriented libraries for the organisation of crystallographic data and the performance of crystallographic computation

Class library (C++) for numbers

cnsface-scripts

coinor-symphony

Column approximate minimum degree ordering algorithm

Data for the Crystallographic Object-Oriented Toolkit

CPPLapack is a C++ class wrapper for BLAS and LAPACK.

An ANSI C implementation of a utility library for quaternion arithmetic and quaternion rotation math

Concise sparse matrix package.

csrosetta-angless

Chemical-Shift-ROSETTA -- ANGLESS DB

Chemical-Shift-ROSETTA -- CS DB

Chemical-Shift-ROSETTA -- PDBH DB

Extended sparse matrix package.

Libraries and applications implementing large parts the DICOM standard

extremely fast library for floating-point convolution

A library of Fortran90 routines to read/write the ETSF file format

factory is a C++ library for representing multivariate polynomials

Fast C library for the Discrete Fourier Transform

Fast Library for Number Theory

A library designed to allow the easy use of XML from Fortran

fpLLL contains several algorithms on lattices

A collection of popular image and signal processing routines

library for using genetic algorithms in C++ programs

Genetic Algorithm Utility Library

GDAL is a translator library for raster geospatial data formats (includes OGR support)

Geometry engine library for Geographic Information Systems

The Gerris Flow Solver

The General Hidden Markov Model library

Givaro is a C++ library for arithmetic and algebraic computations

A three-dimensional finite element mesh generator with built-in pre- and post-processing facilities.

A Tcl package to read and write shapefiles.

The GNU Scientific Library

GNU Triangulated Surface Library

General purpose library and format for storing scientific data

General purpose library and file format for storing scientific data

Integer Matrix Library

INDI Astronomical Control Protocol library

A general purpose trace and experiment file reading/writing interface

Intel(R) Integrated Performance Primitive library for multimedia and data processing

C++ library of mathematical, signal processing and communication classes and functions

Java-like matrix C++ templates

Portions of the Acme collection required for jMol. Courtesy of ACME - Purveyors of fine freeware since 1972.

Sparse LU factorization for circuit simulation

F77 and C LAPACK implementations using available ATLAS routines

lapack-reference

FORTRAN reference implementation of LAPACK Linear Algebra PACKage

lapacke-reference

C++ wrapper for LAPACK libraries

Simple but educational LDL^T matrix factorization algorithm

A C++ implementation of the Levenberg-Marquardt non-linear regression

ECMWF BUFR library - includes both C and Fortran example utilities.

CGNSOO library, provides an object-oriented interface to the CGNS Mid-level library

Cliquer is a set of C routines for finding cliques in an arbitrary weighted graph

lite version of pNMRsim

Robust numerical and geometric computation library

Guile-based library implementing flexible control files for scientific simulations

Implementation of a C++ SDK for DAP 2.0 and 3.2

Library for both the ECW and the ISO JPEG 2000 image file formats

libfac is an extension of Singular-factory to finite fields

GPL Electronic Design Automation: core library

Library for sci-biology/mauve

Library for reading TIFF files with embedded tags for geographic (cartographic) information

Chemical quantum mechanics and molecular mechanics

Virtual Globe library

Used to evaluate traditional and novel two-body matrix elements (integrals) over Cartesian Gaussian functions

Library for sci-biology/mauve

Library for sci-biology/mauve

An OPeNDAP-enabled version of the NetCDF 3.6 API that replaces the standard NetCDF library.

Celestial Mechanics and Astronomical Calculation Library

A library for reading OriginLab OPJ project files

PDB Record I/O Libraries -- c version

PDB Record I/O Libraries -- c++ version

A modern multi-purpose calculator library

C library for quantum computing and quantum simulation

libspatialindex

A macromolecular coordinate superposition library

Library for Support Vector Machines

Library to handle different link cables for TI calculators

Library for communication with TI calculators

Charset conversion library for TI calculators

Library for TI calculator files

A library of exchange-correlation functionals for use in DFT

LinBox is a C++ template library for linear algebra computation over integers and over finite fields

The Locally Weighted Projection Regression Library

Method of four russian for inversion (M4RI)

Math Graphics Library

Library for reading and writing matlab files

Mini-CCP4 library including mtz and map I/O

Modeling and Exchange of Data library

A package for unstructured serial graph partitioning

A C++ physics analysis tool for function minimization

Intel(R) Math Kernel Library: linear algebra, fft, random number generators.

The Coordinate Library is designed to assist CCP4 developers in working with coordinate files

Molecular Modeling ToolKit for Python

C++ library for handling of multiple co-processes

Monomer library used for macromolecular structure building and refinement.

A multiple precision interval arithmetic library based on MPFR

MSMS library python extension module

Function library efficiently solving the Nearest Neighbor Problem(known as the post office problem)

Scientific library and interface for array oriented data access

Non-linear optimization library

Non Uniform Rational Basis Spline (NURBS) library for C++

A python library for manipulation of chemical structures

Network Data Access Protocol client C library

OGDI - Open Geographical Datastore Interface, a GIS support library

Software development platform for CAD/CAE, 3D surface/solid modeling and data exchange.

Open Field Operation and Manipulation - CFD Simulation Toolbox

Open Field Operation and Manipulation - CFD Simulation Toolbox

openfoam-kernel

OpenFOAM - kernel

Open Field Operation and Manipulation - CFD Simulation Toolbox

openfoam-solvers

OpenFOAM - solvers

OpenFOAM - sources

openfoam-utilities

OpenFOAM - utilities

OpenFOAM - wmake

Parallel graph partitioner

Software for parallel (mpi) generating coarse grids

Protein Geometry Database library and Python modules

Multi-language scientific plotting library

A small, fast library to generate primes in order

Proj.4 cartographic projection software with updated NAD27 grids

Provides support for reading and writing of CIF using python

Markov chain Monte Carlo for Python

Software toolkit and library of routines for the analysis and manipulation of macromolecular structural models

A modified version of GiNaC that replaces the dependency on CLN by Python

Quad-double and double-double float arithmetics

ESO stand-alone C library offering easy access to FITS files.

A library for fast updating of QR and Cholesky decompositions

Data required to run RCSB PDB applications

Essential database for rosetta

rosetta-fragments

Fragment library for rosetta

Radar Software Library

Image processing routines for SciPy

A set of python modules for machine learning and data mining

scikits_optimization

Python module for numerical optimization

scikits_statsmodels

Statistical computations and models for use with SciPy

scikits_timeseries

SciPy module for manipulating, reporting, and plotting time series

Scientific algorithms library for Python

Software package and libraries for graph partitioning, static mapping, and sparse matrix block ordering

library for manipulating ESRI Shapefiles

SParse Object Oriented Linear Equations Solver

Multithreaded multifrontal sparse QR factorization library

Statistical analysis and machine learning library

Library for parsing NMR star files (peak-list format) and CIF files

Meta package for a suite of sparse matrix tools

suitesparseconfig

Sparse LU factorization library

A collection of routine to handle a variety of topics

Implementation of the extended-Rice lossless compression algorithm

Technical Analysis Library for analyzing financial markets trends

C library of sparse linear solvers

Template Numerical Toolkit: C++ headers for array and matrices

machine-learning library, written in simple C++

The UCAR/Unidata Units library

Common configuration scripts for the SuiteSparse libraries

Unsymmetric multifrontal sparse LU factorization library

A portable C++ templated library for manipulation, processing and displaying triangle and tetrahedral meshes with OpenGL

vecmath-objectclub

Unofficial free implementation of Sun javax.vecmath by Kenji Hiranabe

vision-workbench

Votca tools library

The Visualization Toolkit

Calculates maximally localized Wannier functions (MLWFs)

A small C-library for reading and writing gromacs trr and xtc files

PMEL fork of XGKS, an X11-based version of the ANSI Graphical Kernel System.

Experimental x-y data reading library

Scientific multi-agent simulation library

A library for polynomial arithmetic