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openblas
|
public |
An optimized BLAS library
|
2023-06-16 |
|
parse
|
None |
parse() is the opposite of format()
|
2023-06-16 |
|
scs
|
None |
scs: splittling cone solver
|
2023-06-16 |
|
ecos
|
None |
A lightweight conic solver for second-order cone programming.
|
2023-06-16 |
|
clusterutils
|
None |
Tools for use in compute cluster environments.
|
2023-06-16 |
|
svgwrite
|
None |
A Python library to create SVG drawings.
|
2023-06-16 |
|
quadprog
|
public |
Quadratic Programming Solver
|
2023-06-16 |
|
openmoltools
|
None |
No Summary
|
2023-06-16 |
|
algopy
|
None |
ALGOPY: Taylor Arithmetic Computation and Algorithmic Differentiation
|
2023-06-16 |
|
pymol
|
None |
No Summary
|
2023-06-16 |
|
pyvisfile
|
None |
Large-scale Visualization Data Storage
|
2023-06-16 |
|
jom
|
public |
jom is a clone of nmake to support the execution of multiple independent commands in parallel.
|
2023-06-16 |
|
cvxpy
|
None |
A domain-specific language for modeling convex optimization problems in Python.
|
2023-06-16 |
|
assaytools
|
None |
A library for the modeling and analysis of plate-based assays (development snapshot)
|
2023-06-16 |
|
cclib
|
None |
cclib: parsers and algorithms for computational chemistry
|
2023-06-16 |
|
mingwpy
|
public |
GCC for Windows 64 & 32 bits
|
2023-06-16 |
|
pyxb
|
None |
PyXB ("pixbee") is a pure Python package that generates Python source code for classes that correspond to data structures defined by XMLSchema.
|
2023-06-16 |
|
ensembler-dev
|
None |
Pipeline for automating omics-scale protein modeling and simulation setup.
|
2023-06-16 |
|
ensembler
|
None |
Pipeline for automating omics-scale protein modeling and simulation setup.
|
2023-06-16 |
|
python-coveralls
|
None |
Python interface to coveralls.io API
|
2023-06-16 |
|
freeglut
|
None |
No Summary
|
2023-06-16 |
|
glew
|
None |
No Summary
|
2023-06-16 |
|
pytram
|
None |
The TRAM package
|
2023-06-16 |
|
openpathsampling-dev
|
None |
OpenPathSampling: A python package to do path sampling simulations
|
2023-06-16 |
|
parmed
|
None |
A package for parsing, interconverting, manipulating, and simulating biomolecular simulations with many packages
|
2023-06-16 |
|
schema
|
None |
Simple data validation library
|
2023-06-16 |
|
subprocess32
|
None |
Backport of the subprocess module from Python 3.2/3.3 for use on 2.x.
|
2023-06-16 |
|
silo
|
None |
Silo is a library for reading and writing a wide variety of scientific data to binary, disk files.
|
2023-06-16 |
|
clapack
|
None |
No Summary
|
2023-06-16 |
|
openmm
|
None |
A high performance toolkit for molecular simulation.
|
2023-06-16 |
|
openmmtools
|
None |
An OpenMM toolkit: test systems, integrators, and alchemical support
|
2023-06-16 |
|
fastcluster
|
None |
Fast hierarchical clustering routines for R and Python.
|
2023-06-16 |
|
pyhmc
|
None |
pyhmc: Hamiltonain Monte Carlo Sampling in Python
|
2023-06-16 |
|
packmol
|
None |
Packing Optimization for Molecular Dynamics Simulations
|
2023-06-16 |
|
pyemma
|
None |
PyEMMA (EMMA = Emma's Markov Model Algorithms) is an open source Python/C package for analysis of extensive molecular dynamics simulations
|
2023-06-16 |
|
numdifftools
|
None |
Solves automatic numerical differentiation problems in one or more variables.
|
2023-06-16 |
|
docopt
|
None |
Pythonic argument parser, that will make you smile
|
2023-06-16 |
|
msmbuilder
|
None |
MSMBuilder: Statistical models for biomolecular dynamics
|
2023-06-16 |
|
pymbar
|
None |
Python implementation of the multistate Bennett acceptance ratio (MBAR) method.
|
2023-06-16 |
|
mdtraj
|
None |
A modern, open library for the analysis of molecular dynamics trajectories
|
2023-06-16 |
|
oset
|
None |
Ordered Set.
|
2023-06-16 |
|
pybtex
|
None |
A BibTeX-compatible bibliography processor in Python
|
2023-06-16 |
|
pybtex-docutils
|
None |
A docutils backend for pybtex.
|
2023-06-16 |
|
yank
|
None |
No Summary
|
2023-06-16 |
|
sphinxcontrib-bibtex
|
None |
A Sphinx extension for BibTeX style citations.
|
2023-06-16 |
|
latexcodec
|
None |
A lexer and codec to work with LaTeX code in Python.
|
2023-06-16 |
|
munkres
|
None |
munkres algorithm for the Assignment Problem
|
2023-06-16 |
|
pdbfixer
|
None |
PDBFixer fixes problems in PDB files to prepare them for molecular simulation.
|
2023-06-16 |
|
ambermini
|
None |
A stripped-down set of just antechamber, sqm, and tleap. See https://github.com/swails/ambermini
|
2023-06-16 |
|
jpype1
|
None |
A Python to Java bridge.
|
2023-06-16 |
