Project ID: plumID:21.039
Source: data/ala2-multi/3_opes_multi_dtica/plumed.dat
Originally used with PLUMED version: 2.8
Stable: zipped raw stdout - zipped raw stderr - stderr
Master: zipped raw stdout - zipped raw stderr - stderr

Click on the labels of the actions for more information on what each action computes
tested onv2.9
tested onmaster
# vim:ft=plumed
Enables syntax highlighting for PLUMED files in vim. See here for more details.

#################################### # >> Alanine Dipeptide << # OPES Multicanonical + Deep-TICA ####################################
# Define CVs phi:
TORSION
Calculate a torsional angle. More details
ATOMS
the four atoms involved in the torsional angle
=5,7,9,15 psi:
TORSION
Calculate a torsional angle. More details
ATOMS
the four atoms involved in the torsional angle
=7,9,15,17 ene:
ENERGY
Calculate the total potential energy of the simulation box. More details

# Define descriptors
INCLUDE
Includes an external input file, similar to #include in C preprocessor. More details. Show included file
FILE
file to be included
=../plumed-descriptors.dat