James Graham
jag1g13
Head of Research Software Engineering at King's College London; former Trustee of the Society of Research Software Engineering
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Top Repositories
Generate coarse-grained molecular dynamics models from atomistic trajectories.
Convert PDB files to LAMMPS data and force field files.
Shows the length of GROMACS XTC files.
Analyse dipoles from MD simulation in LAMMPS format
Repositories
35Generate coarse-grained molecular dynamics models from atomistic trajectories.
Shows the length of GROMACS XTC files.
No description provided.
Convert PDB files to LAMMPS data and force field files.
No description provided.
RSE Group map
A conda-smithy repository for pycgtool.
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A place to submit conda recipes before they become fully fledged conda-forge feedstocks
Code themes in qualitative data with fuzzy matching
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A basic React + NodeJS app to display notes and associated metadata made in Markdown + frontmatter format.
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Repository created for use in the RSE19 Microsoft sponsored workshop
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Dotfiles for Fedora
TINKER Software Tools for Molecular Design
Analyse dipoles from MD simulation in LAMMPS format
Argumentation-based analytics services
Software Carpentry introduction to Python for novices using inflammation data.
A place to create and then store charts used in presentations