2 package "RNA2Dfold" # don't use package if you're using automake
3 purpose "Compute MFE structure, partition function and representative sample structures of k,l neighborhoods"
5 # Version of your program
6 #version "0.9" # don't use version if you're using automake
9 # command line options passed to gengetopt
10 args "--file-name=RNA2Dfold_cmdl --include-getopt --default-optional --func-name=RNA2Dfold_cmdline_parser --arg-struct-name=RNA2Dfold_args_info"
12 description "The program partitions the secondary structure space into (basepair)distance classes according to\
13 two fixed reference structures. It expects a sequence and two secondary structures in dot-bracket notation as\
14 its inputs. For each distance class, the MFE representative, Boltzmann probabilities and Gibbs free energy is\
15 computed. Additionally, a stochastic backtracking routine allows to produce samples of representative suboptimal\
16 secondary structures from each partition\n\n"
20 section "General Options"
21 sectiondesc="Below are command line options which alter the general behavior of this program\n\n"
24 "Do not automatically substitude nucleotide \"T\" with \"U\"\n\n"
29 "Set the number of threads used for calculations (only available when compiled with OpenMP support)\n\n"
36 "calculate partition function and thus, Boltzmann probabilities and Gibbs free energy\n\n"
42 "backtrack a certain number of Boltzmann samples from the appropriate k,l neighborhood(s)\n\n"
46 option "neighborhood" -
47 "backtrack structures from certain k,l-neighborhood only, can be specified multiple times (<k>:<l>,<m>:<n>,...)\n\n"
54 "scaling factor for pf to avoid overflows\n\n"
59 "do not backtrack structures, calculate energy contributions only\n\n"
64 "Assume a circular (instead of linear) RNA molecule.\n\n"
68 section "Model Details"
71 "Rescale energy parameters to a temperature of temp C. Default is 37C.\n\n"
76 "maximum distance to first reference structure"
77 details="If this value is set all structures that exhibit a basepair distance greater than maxDist1 will\
78 be thrown into a distance class denoted by K=L=-1\n\n"
83 "maximum distance to second reference structure"
84 details="If this value is set all structures that exhibit a basepair distance greater than maxDist1 will\
85 be thrown into a distance class denoted by K=L=-1\n\n"
89 "Do not include special tabulated stabilizing energies for tri-, tetra- and hexaloop hairpins. Mostly for testing.\n\n"
93 option "parameterFile" P
94 "Read energy parameters from paramfile, instead of using the default parameter set.\n"
95 details="A sample parameter file should accompany your distribution.\nSee the RNAlib\
96 documentation for details on the file format.\n\n"
101 "How to treat \"dangling end\" energies for bases adjacent to helices in free ends and multi-loops\n"
102 details="\nWith -d2 dangling energies will be added for the bases adjacent to a helix on both sides
103 in any case.\nThe option -d0 ignores dangling ends altogether (mostly for debugging).\n\n"
109 "Do not allow GU pairs\n\n"
113 option "noClosingGU" -
114 "Do not allow GU pairs at the end of helices\n\n"
118 text "\nIf in doubt our program is right, nature is at fault.\nComments should be sent to\
119 rna@tbi.univie.ac.at.\n\n"