1 to 9 of 9 Results
Jul 20, 2022 - SFB 1333 C6 - Holm group, ICP
Tischler, Ingo; Holm, Christian; Schlaich, Alexander, 2022, "Publication data for: "The presence of a wall enhances the probability for ring-closing metathesis: insights from classical polymer theory and atomistic simulations - data from C6 group"", https://doi.org/10.18419/darus-1371, DaRUS, V1
All primary data files and processed data of the journal article from C6 group. It contains the simulation and analysis scripts, the ESPResSo commit and a patch to it, with which the data was produced. |
Python Source Code - 4.0 KB -
MD5: 28fccaf3a93f62ff3ac4528afacf4d68
Analysis script to process the trajectories to gather the end to end distance distribution. |
Unknown - 4.1 KB -
MD5: 6bddff4d38d77d4f7c075b7cdb608a0a
Condor script to run the simulations |
Unknown - 55.3 KB -
MD5: 2e3c6b7974b0604fceae0632183a9afb
Condor script to run the simulations |
Python Source Code - 9.4 KB -
MD5: eceb54902de6a8af5e0779d3173d3e6b
Base simulation script |
Plain Text - 91 B -
MD5: fa50fd012e797dbb9fd950cee082e756
ESPResSo web page and commit used |
Python Source Code - 11.0 KB -
MD5: b1c5b77af38f0f98c8738c8351953d6c
|
TAR Archive - 2.8 MB -
MD5: a159e8f09a462a29a4017671a7c905b6
|
text/x-patch - 5.3 KB -
MD5: d76b4b5b6a7d66a1fea6fc52efd635af
git patch to add the reflecting walls |