mcxio - the format specifications for input and output in the mcl family.
The primary objects in the MCL network analysis suite are graphs and
clusterings. Graphs can be directed and may have loops. Both graphs and
clusterings are represented in a general unified format. This format specifies
two domains (a
source domain and a
destination domain), along
with lists of arcs linking pairs of elements from the two domains. For graphs
the two domains are simply both equal to the graph node domain, whereas for
clusterings one domain is the graph node domain and the other corresponds to
the enumeration of clusters. Undirected graphs are a special instance of a
directed graph, where an edge from the undirected graph is represented by two
arcs of identical weight, one for each possible direction.
The general unified format alluded to above is in fact a simple rectangular
sparse matrix representation. Sparse means that zero entries in the matrix are
not stored. A zero entry corresponds to an ordered node pair in the graph for
which no arc exists from the first to the second node. An undirected graph
corresponds with a symmetric matrix.
The MCL suite uses a slight generalisation of the matrix concept, in that the
row and column indices (that is, domains) can be arbitrary lists of
nonnegative integers. Usually, but not necessarily, a domain of size N
will use the common representation of the list of integers starting at 0
and ending at N-1. The
source domain is always associated with
the columns of a matrix, and the
destination domain is always
associated with the rows of a matrix. The matrix format, introduced below,
first specifies the two domains. It then represents the nonzero matrix entries
(corresponding with graph arc weights) in a column-wise fashion, as a list of
lists. For each node from the source domain, it presents the list of all its
neighbours in the destination domain along with the corresponding weights.
This document describes
native matrix format
The format that can be read in by any mcl application expecting a matrix
argument. The native format closely resembles the layout of matrices as
residing in computer memory. There are two distinct encodings, respectively
interchange and
binary. Their relative merits are described
further below.
concatenated native matrix format
This always pertains to matrices in native format concatenated in a single file,
refered to as a
cat file. It is used for example to encode hierarchical
clusterings as generated by
mclcm. A cat file either consists of
matrices in interchange format or of matrices in binary format.
raw intermediate format
This is read by
mcxassemble(1).
tab format
Used by applications such as
mcl(1) and
mcxdump(1) to convert
between meaningful labels describing the input data and the numerical
identifiers used internally.
label format
The format used when streaming labels directly into
mcl(1) or
mcxload(1).
transformation syntax
The syntax accepted by
mcl(1),
mcxalter(1) and many other programs
to transform graphs and matrices.
The interchange format is a portable format that can be transmitted across
computers and over networks and will work with any version of mcl or its
sibling programs. It is documented (here) and very stable. Applications can
easily create matrices in this format. The drawback of interchange format is
that for very large graphs matrix encodings grow very big and are slow to
read.
The binary format is
not garantueed to be portable across machines or
different versions of mcl or differently compiled versions of mcl. Its
distinct advantage is that for very large graphs the speed advantage over
interchange format is dramatic.
Conversion between the two formats is easily achieved with
mcxconvert.
Both
mcl(1) and
mcxload(1) can save a matrix in either format
after constructing it from label input.
The concatenated format is generated e.g. by
mclcm(1) and can be
transformed by
mcxdump(1) using the
-imx-cat option. In cat
format matrices are simply concatenated, so it is easily generated from the
command line if needed. For native binary format it is imperative that no
additional bytes are inserted inbetween the matrix encodings. For native
interchange format the only requirement is that the last matrix is followed by
nothing but white space.
A remark on the sloppy naming conventions used for
mcl and its sibling
utilities may be in order here. The prefix
mcx is used for generic
matrix functionality, the prefix
clm is used for generic cluster
functionaliy. The
utility mcx is a general purpose interpreter
for manipulating matrices (and grahps, sets, and clusterings). The set of all
mcl siblings (cf.
mclfamily(7)) is loosely refered to as the mcl
family, which makes use of the mcl libraries (rather than the mcx libraries).
The full truth is even more horrible, as the mcl/mcx prefix conventions used
in the C source code follow still other rules.
In this document, 'MCL' means 'the mcl setting' or 'the mcl family'. An MCL
program is one of the programs in the mcl family. The remainder of this
document contains the following sections.
There are several aspects to the way in which MCL represents matrices.
Internally, indices never act as an ofset in an array, and neither do they
participate in ofset computations. This means that they purely act as
identifiers. The upshot is that matrices can be handled in which the index
domains are
non-sequential (more below). Thus one can work with
different graphs and matrices all using subsets of the same set of
indices/identifiers. This aids in combining data sets in different ways and
easily comparing the respective results when experimenting. Secondly, only
nonzero values (and their corresponding indices) are stored. Thirdly,
MCL stores a matrix as a listing of columns. Iterating over a column is
trivial; iterating over a row requires a costly transposition computation. The
last two points should matter little to the user of MCL programs.
In textbook expositions and in many matrix manipulation implementations,
matrices are represented with sequentially indexed rows and columns, with the
indices usually starting at either zero or one. In the MCL setting, the
requirement of sequentiality is dropped, and it follows naturally that no
requirement is posed on the first index. The only requirement MCL poses on the
indices is that they be nonnegative, and can be represented by the integer
type used by MCL. On many machines, the largest allowable integer will be
2147483647.
MCL associates two domains with a matrix M, the row domain and column
domain. The matrix M can only have entries M[i,j] where i is in
the row domain and j is in the column domain. This is vital when
specifying a matrix: it is illegal to specify an entry M[i,j] violating
this condition. However, it is not necessary to specify
all
entries M[i,j] for all possible combinations of i and j. One
needs only specify those entries for which the value is nonzero, and only
nonzero values will be stored internally. In the MCL matrix format, the matrix
domains must be specified explicitly if they are not canonical (more below).
Strictly as an aside, the domains primarily exist to ensure data
integrity. When combining matrices with addition or multiplication (e.g. using
the
mcx utility), MCL will happily combine matrices for which the
domains do not match, although it will usually issue a warning. Conceptually,
matrices auto-expand to the dimensions required for the operation.
Alternatively, a matrix can be viewed as an infinite quadrant, with the
domains delimiting the parts in which nonzero entries may exist. In the
future, facilities could be added to MCL (c.q.
mcx) to allow for
placing strict domain requirements on matrices when submitted to binary
operations such as addition and multiplication.
From here on, all statements about matrices and graphs are really statements
about matrices and graphs
in the MCL setting. The
specification
of a matrix quite closely matches the internal representation.
A matrix M has two domains: the column domain and the row domain. Both simply
take the form of a set (represented as an ordered list) of indices. A
canonical domain is a domain of some size K where the indices are
simply the first K nonnegative integers 0,1..,K-1. The domains dictate which
nonzero entries are allowed to occur in a matrix; only entries M[i,j] are
allowed where i is in the row domain and j is in the column domain.
The matrix M is specified in three parts, for which the second is optional. The
parts are:
Header specification
This specifies the dimensions K and L of the matrix, where K is the size of the
row domain, and L is the size of the column domain. It looks as follows:
(mclheader
mcltype matrix
dimensions 9x14
)
This dictates that a matrix will be specified for which the row domain has
dimension 9 and the column domain has dimension 14.
Domain specification
The domain specification can have various forms: if nothing is specified, the
matrix will have canonical domains and a canonical representation, similar to
the representation encountered in textbooks. Alternatively, the row and column
domains can each be specified separately, and it is also possible to specify
only one of them; the other will simply be a canonical domain again. Finally,
it is possible to declare the two domains identical and specify them
simultaneously. It is perfectly legal in each case to explicitly specify a
canonical domain. It is
required in each case that the number of
indices listed in a domain corresponds with the dimension given in the header.
An example where both a row domain and a column domain are specified:
(mclrows
100 200 300 400 500 600 700 800 900 $
)
(mclcols
30 32 34 36 38 40 42 44 46 48 50 52 56 58 $
)
This example combines with the header given above, as the dimensions fit. Had
the row domain specification been omitted, the row domain would automatically
be set to the integers 0,1,..8. Had the column specification been omitted, it
would be set to 0,1,..13.
Suppose now that the header did specify the dimensions 10x10. Because the
dimensions are identical, this raises the possibility that the domains be
identical. A valid way to specify the row domain and column domain in one go
is this.
(mcldoms
11 22 33 44 55 66 77 88 99 100 $
)
Matrix specification
The matrix specification starts with the sequence
(mclmatrix
begin
The 'begin' keyword in the '(mclmatrix' part is followed by a list of listings,
where the primary list ranges over all column indices in M (i.e. indices in
the column domain), and where each secondary lists encodes all positive
entries in the corresponding column. A secondary list (or matrix column)
starts with the index c of the column, and then contains a listing of all row
entries in c (these are matrix entries M[r,c] for varying r). The entry M[r,c]
is specified either as 'r' or as 'r:f', where f is a float. In the first case,
the entry M[r,c] defaults to 1.0, in the second case, it is set to f. The
secondary list is closed with the `$' character. A full fledged examples thus
looks as follows:
(mclheader
mcltype matrix
dimensions 12x3
)
(mclrows
11 22 33 44 55 66 77 88 99 123 456 2147483647 $
)
(mclcols
0 1 2 $
)
(mclmatrix
begin
0 44 88 99 456 2147483647 $
1 11 66 77 123 $
2 22 33 55 $
)
Note that the column domain is canonical; its specifiation could have been
omitted. In this example, no values were specified. See below for more.
A graph is simply a matrix where the row domain is the same as the column
domain. Graphs should have positive entries only. Example:
(mclheader
mcltype matrix
dimensions 12x12
)
(mcldoms
11 22 33 44 55 66 77 88 99 123 456 2147483647 $
)
(mclmatrix
begin
11 22:2 66:3.4 77:3 123:8 $
22 11:2 33:3.8 55:8.1 $
33 22:3.8 44:7 55:6.2 $
44 33:7 88:5.7 99:7.0 456:3 $
55 22:8.1 33:6.2 77:2.9 88:3.0 $
66 11:3.4 123:5.1 $
77 11:3 55:2.9 123:1.5 $
88 44:5.7 55:3.0 99:3.0 456:4.2 $
99 44:7.0 88:3.0 456:1.8 2147483647:3.9 $
123 11:8 66:5.1 77:1.5 $
456 44:3 88:4.2 99:1.8 2147483647:6.3 $
2147483647 99:3.9 456:6.3 $
)
Incidentally, clustering this graph with mcl, using default parameters, yields a
cluster that is represented by the 12x3 matrix shown earlier.
The following example shows the same graph, now represented on a canonical
domain, and with all values implicitly set to 1.0:
(mclheader
mcltype matrix
dimensions 12x12
)
(mclmatrix
begin
0 1 5 6 9 $
1 0 2 4 $
2 1 3 4 $
3 2 7 8 10 $
4 1 2 6 7 $
5 0 9 $
6 0 4 9 $
7 3 4 8 10 $
8 3 7 10 11 $
9 0 5 6 $
10 3 7 8 11 $
11 8 10 $
)
Additional notes
There are few restrictions on the format that one might actually expect. Vectors
and entries may occur in any order and need not be sorted. Repeated entries
and repeated vectors are allowed but are always discarded while an error
message is emitted.
If you want
functionally interesting behaviour in combining repeated
vectors and repeated entries, have a look at the next section and at
mcxassemble(1).
Within the vector listing, the '#' is a token that introduces a comment until
the end of line.
A file in
raw format is simply a listing of vectors without any
sectioning structure. No header specification, no domain specification, and no
matrix introduction syntax is used - these are supplied to the processing
application by other means. The end-of-vector token '$' must still be used,
and the comment token '#' is still valid.
mcxassemble(1) imports a file
in raw format, creates a native matrix from the data therein, and writes the
matrix to (a different) file. It allows customizable behaviour in how to
combine repeated entries and repeated vectors. This is typically used in the
following procedure. A) Do a one-pass-parse on some external cooccurrence
file/format, generate raw data during the parse and write it to file (without
needing to build a huge data structure in memory). B) mcxassemble takes the
raw data and assembles it according to instruction into a native mcl matrix.
Several mcl programs accept options such as
-tab,
-tabc,
-tabr,
-use-tab,
-strict-tab, and
-extend-tab. The
argument to these options is invariably the name of a so-called
tab
file. Tab files are used to convert between labels (describing entities in
the data) and indices as used in the mcl matrix format. In a tab file each
line starts with a unique number which presumably corresponds to an index used
in a matrix file. The rest of the line contains a descriptive string
associated with the number. It is required that each string is unique,
although not all mcl programs enforce this at the time of writing. The string
may contain spaces. Lines starting with # are considered comment and are
disregarded.
Tab domain
The ordered set of indices found in the tab file is called the
tab
domain.
Tab files are almost always employed in conjunction with an mcl matrix file.
mcxdump(1) and
clmformat(1) require by default that the tab
domain coincides with the matrix domain (either row or column or both) to
which they will be applied. This can be relaxed for either by supplying the
--lazy-tab option.
mcl provides explicit modes for dealing with tab structures by means of the
-extend-tab,
-restrict-tab and
-strict-tab options. Refer
to the
mcl(1) documentation.
Label input is a line based input where two nodes and an optional value are
specified on each line. The nodes should be specified by labels. If the labels
contain spaces they should be separated by tabs (and the value if present
should be separated from the second label by a tab as well). The parse code
will assume tab-separated labels if it sees a tab character in the input,
otherwise it will split the input on any kind of whitespace. Any line where
the first non-whitespace character is the octothorp (#) is ignored. The
following is an example of label input.
---8<------8<------8<------8<------8<---
# the cat and the hat example
cat hat 0.2
hat bat 0.16
bat cat 1.0
bat bit 0.125
bit fit 0.25
fit hit 0.5
hit bit 0.16
--->8------>8------>8------>8------>8---
mcl(1) can read in label input and cluster it when it is given the
--abc option. It can optionally save the input graph in native format
and save the label information in a tab file with the
-save-graph and
-save-tab options.
Refer to the
MCL getting started and
MCL manual examples sections
for more information on how MCL deals with label input.
mcxload(1) is a general purpose program for reading in label data and
other stream formats. It encodes them in native mcl format and tab files. It
allows intermediate transformations on the values.
mcl(1),
mcxload(1),
mcxsubs(1),
mcxassemble(1) and
mcxalter(1) all accept the same transformation language in their
respective
tf-type options and mcxsub's
val specification.
A statement in this language is simply a comma-separated list of functions
accepting a single numerical value. The syntax of a function invocation in
general is
func(
arg). The functions
exp,
log,
neglog can also be given an empty parameter list, indicating that
e is taken as the exponent base. In this case, the invocation looks
like
func(). Functions with names that start with # operate on graphs
in their entirety. For example, #knn(50) indicates the k-Nearest Neighbour
transformation for k=50. All other names encode functions that operate
directly on edges. Functions with names that start with #arc operate on
directed graphs and yield directed graphs. Most of the other # functions
either expect an undirected graph (such as #knn()) or yield an undirected
graph (such as #add() and #max(). The following are supported.
lt Filter out values greater than or equal to arg.
lq Filter out values greater than arg.
gq Filter out values less than arg.
gt Filter out values less than or equal to arg.
ceil Set everything higher than arg to arg.
floor Set everything lower than arg to arg.
mul Multiply by arg.
add Add arg to it.
power Raise to power arg.
exp Raise arg (
e if omitted) to value.
log Take log in base arg (
e if omitted).
neglog Take minus log in base arg (
e if omitted).
#knn k-Nearest Neighbour reduction with k=arg.
#ceilnb Cap neighbours at arg at most.
#mcl Cluster with inflation=arg, use induced graph.
#add Convert two arcs to one edge using addition.
#min Convert two arcs to one edge using minimum.
#max Convert two arcs to one edge using maximum.
#mul Convert two arcs to one edge using multiplication.
#rev Encode graph in reverse direction.
#tp Same as above in matrix speak (
trans
pose).
#tug Perturb edge weights with factor arg.
#shrug Randomly perturb edge weights with factor arg.
#step Use the k-step relation, where k=arg.
#thread Set thread pool size to arg.
#arcmax Only keep largest arc between two nodes.
#arcsub Replace G by G - G^T.
#arcmcl As #mcl, use symmetrised graph for clustering.
NOTE
mcl(1) accepts
--abc-neg-log and
--abc-neg-log10 to specify
log transformations. Similarly,
mcxload(1) accepts
--stream-log,
--stream-neg-log, and
--stream-neg-log10. The reason is that
probabilities are sometimes encoded below the precision dictated by the IEEE
(32 bit) float specification. This poses a problem as the mcl applications
encode values by default as floats, and the transformation specifications are
always applied to the mcl encoding. The options just mentioned are applied
after a value has been read from an input stream and
before it is
converted to the native encoding.
mcxassemble(1), and
mclfamily(7) for an overview of all the
documentation and the utilities in the mcl family.
Stijn van Dongen.