Mercurial > repos > agpetit > calculate_diameter

view test-data/PIP2.1_test_traj_3.tabular @ 2:c574ada16e76 draft

Find changesets by keywords (author, files, the commit message), revision number or hash, or revset expression.
"planemo upload for repository https://github.com/mesocentre-clermont-auvergne/aubi_piaf commit 48a10de1b21f94ab8019d9d0e4a43e0bd9d0c31e-dirty"
author agpetit
date Wed, 25 May 2022 09:42:17 +0000
parents
children
line wrap: on
line source

Time (ps)	AQP1,P1,HLAT-RSFG (Angstroms)	AQP1,P2,HLAT-RSFG (Angstroms)	AQP1,P3,HLAT-RSFG (Angstroms)	AQP1,P4,HLAT-RSFG (Angstroms)	AQP2,P1,HLAT-RSFG (Angstroms)	AQP2,P2,HLAT-RSFG (Angstroms)	AQP2,P3,HLAT-RSFG (Angstroms)	AQP2,P4,HLAT-RSFG (Angstroms)
Mean	13.563	12.911	13.158	13.416	13.148	13.083	13.498	13.451
Std	0.252	0.253	0.372	0.081	0.551	0.324	0.222	0.165
60.0	13.618790626525879	13.018404006958008	12.811575889587402	13.301225662231445	12.109633445739746	12.846515655517578	13.861187934875488	13.744926452636719
70.0	13.661763191223145	12.746076583862305	13.560006141662598	13.544204711914062	13.41203498840332	13.181901931762695	13.379557609558105	13.279899597167969
80.0	13.943700790405273	13.358064651489258	12.832847595214844	13.416825294494629	13.551321029663086	13.333117485046387	13.339651107788086	13.309863090515137
90.0	13.204079627990723	12.662531852722168	13.659078598022461	13.447236061096191	13.070229530334473	13.468667030334473	13.645709991455078	13.437175750732422
100.0	13.384292602539062	12.76912784576416	12.92572021484375	13.37130069732666	13.59439468383789	12.585389137268066	13.26440143585205	13.485139846801758