hothello

A computational chemist and code monkey (^___^);

MaterialXBristol

Pinned Repositories

EMMO
Elementary Multiperspective Material Ontology (EMMO)
Language:Shell58 14 11416
backmap_legacy
Language:Makefile0 0 00
EMMO
Elementary Multiperspective Material Ontology (EMMO)
Language:Shell0 0 00
materialx-blog
Language:JavaScript0 0 00
moltemplate
A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
Language:Python0 0 00
openmodel
Use Case for the OpenModel project
Language:Perl2 3 01
openmodel02
Simplified multiscale simulation for the OpenModel project.
Language:Perl1 1 00
plga_aa
LAMMPS input deck for atomistic PLGA polymer. Ref: 10.1557/s43577-022-00380-9
Language:Shell0 1 00
moltemplate
A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
Language:Python241 15 5793
lammps
Public development project of the LAMMPS MD software package
Language:C++2.1k 118 1k1.7k

hothello's Repositories

hothello/openmodel
Use Case for the OpenModel project
Language:Perl2 3 01
hothello/openmodel02
Simplified multiscale simulation for the OpenModel project.
Language:Perl1 1 00
hothello/backmap_legacy
Language:Makefile0 0 00
hothello/EMMO
Elementary Multiperspective Material Ontology (EMMO)
Language:Shell0 0 00
hothello/materialx-blog
Language:JavaScript0 0 00
hothello/moltemplate
A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
Language:Python0 0 00
hothello/plga_aa
LAMMPS input deck for atomistic PLGA polymer. Ref: 10.1557/s43577-022-00380-9
Language:Shell0 1 00