jag1g13
Head of Research Software Engineering at King's College London; former Trustee of the Society of Research Software Engineering
King's College LondonUK
Pinned Repositories
python-intermediate-development
"Intermediate Research Software Development Skills (Python)" Lesson Material
dipoleAnalysis
Analyse dipoles from MD simulation in LAMMPS format
fuzzycoding
Code themes in qualitative data with fuzzy matching
pdb2lmp
Convert PDB files to LAMMPS data and force field files.
pycgtool
Generate coarse-grained molecular dynamics models from atomistic trajectories.
xtc-length
Shows the length of GROMACS XTC files.
PEDASI
A platform for research in data sharing
lowfat
The Software Sustainability Institute's low effort Fellowship Administration Tool (lowFAT). Contact: @gperu
github-analysis
jag1g13's Repositories
jag1g13/pycgtool
Generate coarse-grained molecular dynamics models from atomistic trajectories.
jag1g13/pdb2lmp
Convert PDB files to LAMMPS data and force field files.
jag1g13/xtc-length
Shows the length of GROMACS XTC files.
jag1g13/cgtool
jag1g13/fuzzycoding
Code themes in qualitative data with fuzzy matching
jag1g13/2020-software-engineering-day4
jag1g13/carpentries-sample
jag1g13/dipoleAnalysis-bitbucket
jag1g13/dotfiles-fedora
Dotfiles for Fedora
jag1g13/evidence-bank
jag1g13/Graphing-for-presentations
A place to create and then store charts used in presentations
jag1g13/lammps
Public/backup repository of the LAMMPS MD software package
jag1g13/lesson-example
jag1g13/md-notes-template
jag1g13/mdtraj-macos-test
jag1g13/minimd
jag1g13/note-tasks
jag1g13/notes-js
A basic React + NodeJS app to display notes and associated metadata made in Markdown + frontmatter format.
jag1g13/pycgtool-feedstock
A conda-smithy repository for pycgtool.
jag1g13/python-novice-inflammation
Software Carpentry introduction to Python for novices using inflammation data.
jag1g13/ramsi
jag1g13/raw1394-dummy
Dummy Linux kernel module for FireWire raw1394
jag1g13/rse-groups
RSE Group map
jag1g13/rse19-ms-workshop
Repository created for use in the RSE19 Microsoft sponsored workshop
jag1g13/sabs_01_2
jag1g13/sabs_01_2_2
jag1g13/staged-recipes
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
jag1g13/traj_process
jag1g13/u1f345
jag1g13/webservices
Argumentation-based analytics services