frobnitzem/realpole

Stars
1
Language
Python
License
GNU General Publi...
Created over 9 years ago
Updated over 3 years ago

frobnitzem/realpole

frobnitzem

There are no reviews yet. Be the first to send feedback to the community and the maintainers!

Code for real-space quadrature representation of multipole expansions

pbctools

Development version of the pbctools plugin for VMD.

rbtree

C Implementation of Red/Black Trees

libdag

GNU-C and Posix Thread Library for Parallel Execution of Task Graphs

mpi_list

A package for working with lists distributed over MPI

hirshfeld

Hirshfeld Analysis module for PySCF

spackCF

Spack Wrapper for Compute Facilities

aiowire

aiowire - A simple event loop using asyncio

chan9

Fork of the go9p library at code.google.com/p/go9p

lclstream

Image streaming application for psana.

EwaldCorrel

Simultaneous Implementation of Smooth Particle Mesh Ewald summation and Fourier Space Correlation Calculations

indysccapi

A REST API for Programming Competition Results

scicomp-recipes

Recipes for Scientific Computing

nightly

Nightly Build and Run Testing System

classifier

Monte Carlo Sampler for Bernoulli Mixture Models

chemparam

Automate force matching for legacy forcefields

hpl-hpcg

HPL & HPCG Walkthrough

rc-org

An organization promoting the adoption and standardization of the rc shell.

psik

Portable Submission Interface for Jobs

BDAS

Parallel Core Data Analytics Methods in Python/Numpy/Cupy/Mpi4Py

slack

SLACK: Standard Linear Array Computation Kernels

dwork

Distributed Work Scheduling System

sprotoc

Callback-based Implementation of Google Protocol Buffers for C

forcesolve

General Purpose Programmable Force Matching Code

sars_docking

Summary secondary data and scripts for working with SARS-Cov2 gigadocking dataset: https://dx.doi.org/10.13139/OLCF/1783186

autoQCT

Automated QCT Analysis