Open Hub
Open Hub

Tags : Browse Projects

Select a tag to browse associated projects and drill deeper into the tag cloud.

CrysFML

Compare

  No analysis available

The Crystallographic Fortran Modules Library (CrysFML) is a set of Fortran 95 modules containing procedures of interest in Crystallographic applications. This set of modules has been, and is still being developed, by us in order to facilitate the design and the development of crystallographic ... [More] computing programs. The whole library is written in a subset of Fortran 95 (F-language) for which free compilers are available. The source code is freely available to those academic groups interested in cooperative scientific software development. [Less]

0 lines of code

7 current contributors

0 since last commit

2 users on Open Hub

Activity Not Available
5.0
 
0 Reviews
I Use This
Mostly written in language not available
Licenses: lgpl21_or...
Tags crystal crystallography diffraction fortran ill linux llb mac neutron neutrons physics powder 5 more...

Force Field X

Compare

  Analyzed about 1 month ago

Force Field X (FFX) is a group of open source (GPL v. 3 with Linking Exception), platform independent modules for molecular biophysics. Key methods include: 1) Atomic Multipole Optimized Energetics for Biomolecular Applications (AMOEBA) force fields 2) Particle-mesh Ewald (PME) electrostatics with ... [More] support for space group symmetry 3) Generalized Kirkwood continuum electrostatics 4) Single and Dual-Topology Orthogonal Space Random Walk (OSRW) free energy methods 5) L-BFGS, Simulated Annealing and Dead-End Elimination optimization algorithms 6) Reciprocal space refinement for X-ray and Neutron Diffraction data sets 7) Real space refinement for X-ray Diffraction, Neutron Diffraction and CryoEM data sets 8) Shared memory, cluster parallel and coprocessor based parallelization strategies [Less]

385K lines of code

9 current contributors

3 months since last commit

1 users on Open Hub

Activity Not Available
5.0
 
0 Reviews
I Use This
Mostly written in Java
Licenses: gpl_class...
Tags drug-design gpu java molecular-dynamics molecular-modelling molecular-simulation parallel protein protein-kinase protein-structure scientific-computing scientificcomputing 2 more...

CIL - Core Imaging Library

Compare

  Analyzed about 1 month ago

A versatile python framework for tomographic imaging

31.8K lines of code

0 current contributors

3 months since last commit

1 users on Open Hub

Activity Not Available
0.0
 
0 Reviews
I Use This
Mostly written in Python
Licenses: apache_2
Tags neutrons python reconstruction stfc tomography xray

scikit-beam

Compare

  Analyzed about 1 month ago

Data analysis tools for X-Ray, Neutron and Electron sciences

11.8K lines of code

9 current contributors

over 1 year since last commit

0 users on Open Hub

Activity Not Available
0.0
 
0 Reviews
I Use This
Mostly written in Python
Licenses: BSD-3-Clause
Tags python3 science scienceresearch xray