IMP
2.3.1
The Integrative Modeling Platform
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Composable functors to implement scores via compile-time composition. More...
Composable functors to implement scores via compile-time composition.
Currently, there is support for distance based IMP::PairScore types generated from the IMP::scoring_function::DistanceScore and IMP::scoring_function::DistancePairScore. Angles and others can be added if desired.
No functionality is exported to Python. It can be done with some work, but it is not clear that it would be very useful.
Author(s): Daniel Russel
Maintainer: benmwebb
License: LGPL This library is free software; you can redistribute it and/or modify it under the terms of the GNU Lesser General Public License as published by the Free Software Foundation; either version 2 of the License, or (at your option) any later version.
Publications:
Classes | |
class | AddScores |
class | DistancePairScore |
Create efficient distance-based pair scores. More... | |
class | Dope |
class | Harmonic |
class | HarmonicLowerBound |
class | HarmonicUpperBound |
class | LinearLowerBound |
class | OpenCubicSpline |
Open cubic spline function. More... | |
class | OrientedSoap |
Orientation-dependent SOAP score. More... | |
struct | Score |
A functor for computing a distance based score for two particles. More... | |
class | ScoreUnaryFunction |
class | Shift |
class | SingletonStatistical |
class | Soap |
class | SphereDistance |
class | Statistical |
class | UnaryFunctionEvaluate |
class | WeightScore |
Typedefs | |
typedef Key< 6453462, false > | DopeType |
typedef IMP::base::Vector < DopeType > | DopeTypes |
Standard module functions | |
All | |
std::string | get_module_version () |
std::string | get_module_name () |
std::string | get_data_path (std::string file_name) |
Return the full path to installed data. More... | |
std::string | get_example_path (std::string file_name) |
Return the path to installed example data for this module. More... | |
typedef Key<6453462, false> IMP::score_functor::DopeType |
std::string IMP::score_functor::get_data_path | ( | std::string | file_name | ) |
Return the full path to installed data.
Each module has its own data directory, so be sure to use the version of this function in the correct module. To read the data file "data_library" that was placed in the data
directory of module "mymodule", do something like
This will ensure that the code works when IMP
is installed or used via the setup_environment.sh
script.
std::string IMP::score_functor::get_example_path | ( | std::string | file_name | ) |
Return the path to installed example data for this module.
Each module has its own example directory, so be sure to use the version of this function in the correct module. For example to read the file example_protein.pdb
located in the examples
directory of the IMP::atom module, do
This will ensure that the code works when IMP
is installed or used via the setup_environment.sh
script.