Language Breakdown
Lines of code distribution across 27 owned repositories
I-Shaped Developer
I-shapedSpecialist — deep expertise in Jupyter Notebook
Collaboration Network
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Repos
69
PRs
0
Growth
+18%
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Coding Streak
Contribution activity over the past year
Simone Martino
@SimoneMartino98
Guillaume Fraux
@Luthaf
Philipp Pracht
@pprcht
Paul Iacomi
@pauliacomi
Thomas Nicholas
@tcnicholas
Top Repositories
Molecular size calculation based on ellipsoid fitting over N conformers
Implementation of cheap Monte Carlo optimisation of bonds in molecules
cavity shape and size mapping by growing a guest inside a host
collection of cage structures extracted from the CSD and analyzed
Prepare your building blocks for stk construction and analysis
Some example usages of stk (and stko, mchammer)
A general tool set for working with coarse-grained stk models
Construct and study large cages with unsymmetrical ligands
Low-cost host-guest conformer generation
Open Source Impact
Contributions to external projects