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/* RAxML-VI-HPC (version 2.2) a program for sequential and parallel estimation of phylogenetic trees
* Copyright August 2006 by Alexandros Stamatakis
*
* Partially derived from
* fastDNAml, a program for estimation of phylogenetic trees from sequences by Gary J. Olsen
*
* and
*
* Programs of the PHYLIP package by Joe Felsenstein.
*
* This program is free software; you may redistribute it and/or modify its
* under the terms of the GNU General Public License as published by the Free
* Software Foundation; either version 2 of the License, or (at your option)
* any later version.
*
* This program is distributed in the hope that it will be useful, but
* WITHOUT ANY WARRANTY; without even the implied warranty of MERCHANTABILITY
* or FITNESS FOR A PARTICULAR PURPOSE. See the GNU General Public License
* for more details.
*
*
* For any other enquiries send an Email to Alexandros Stamatakis
* Alexandros.Stamatakis@epfl.ch
*
* When publishing work that is based on the results from RAxML-VI-HPC please cite:
*
* Alexandros Stamatakis:"RAxML-VI-HPC: maximum likelihood-based phylogenetic analyses
* with thousands of taxa and mixed models".
* Bioinformatics 2006; doi: 10.1093/bioinformatics/btl446
*/
#include <assert.h>
#include <stdint.h>
#include "../versionHeader/version.h"
#define BYTE_ALIGNMENT 32
#define MAX_TIP_EV 0.999999999 /* max tip vector value, sum of EVs needs to be smaller than 1.0, otherwise the numerics break down */
#define smoothings 32 /* maximum smoothing passes through tree */
#define iterations 10 /* maximum iterations of iterations per insert */
#define newzpercycle 1 /* iterations of makenewz per tree traversal */
#define nmlngth 256 /* number of characters in species name */
#define deltaz 0.00001 /* test of net branch length change in update */
#define defaultz 0.9 /* value of z assigned as starting point */
#define unlikely -1.0E300 /* low likelihood for initialization */
#define SUMMARIZE_LENGTH -3
#define SUMMARIZE_LH -2
#define NO_BRANCHES -1
#define MASK_LENGTH 32
#define GET_BITVECTOR_LENGTH(x) ((x % MASK_LENGTH) ? (x / MASK_LENGTH + 1) : (x / MASK_LENGTH))
#define zmin 1.0E-15 /* max branch prop. to -log(zmin) (= 34) */
#define zmax (1.0 - 1.0E-6) /* min branch prop. to 1.0-zmax (= 1.0E-6) */
#define twotothe256 \
115792089237316195423570985008687907853269984665640564039457584007913129639936.0
/* 2**256 (exactly) */
#define minlikelihood (1.0/twotothe256)
#define minusminlikelihood -minlikelihood
/* 18446744073709551616.0 */
/*4294967296.0*/
/* 18446744073709551616.0 */
/* 2**64 (exactly) */
/* 4294967296 2**32 */
#define badRear -1
//#define NUM_BRANCHES 1
#define TRUE 1
#define FALSE 0
#define LIKELIHOOD_EPSILON 0.0000001
#define AA_SCALE 10.0
#define AA_SCALE_PLUS_EPSILON 10.001
/* ALPHA_MIN is critical -> numerical instability, eg for 4 discrete rate cats */
/* and alpha = 0.01 the lowest rate r_0 is */
/* 0.00000000000000000000000000000000000000000000000000000000000034878079110511010487 */
/* which leads to numerical problems Table for alpha settings below: */
/* */
/* 0.010000 0.00000000000000000000000000000000000000000000000000000000000034878079110511010487 */
/* 0.010000 yielded nasty numerical bugs in at least one case ! */
/* 0.020000 0.00000000000000000000000000000044136090435925743185910935350715027016962154188875 */
/* 0.030000 0.00000000000000000000476844846859006690412039180149775802624789852441798419292220 */
/* 0.040000 0.00000000000000049522423236954066431210260930029681736928018820007024736185030633 */
/* 0.050000 0.00000000000050625351310359203371872643495343928538368616365517027588794007897377 */
/* 0.060000 0.00000000005134625283884191118711474021861409372524676086868566926568746566772461 */
/* 0.070000 0.00000000139080650074206434685544624965062437960128249869740102440118789672851562 */
/* 0.080000 0.00000001650681201563587066858709818343436959153791576682124286890029907226562500 */
/* 0.090000 0.00000011301977332931251259273962858978301859735893231118097901344299316406250000 */
/* 0.100000 0.00000052651925834844387815526344648331402709118265192955732345581054687500000000 */
#define ALPHA_MIN 0.02
#define ALPHA_MAX 1000.0
#define RATE_MIN 0.0000001
#define RATE_MAX 1000000.0
#define INVAR_MIN 0.0001
#define INVAR_MAX 0.9999
#define TT_MIN 0.0000001
#define TT_MAX 1000000.0
#define FREQ_MIN 0.001
/*
previous values between 0.001 and 0.000001
TO AVOID NUMERICAL PROBLEMS WHEN FREQ == 0 IN PARTITIONED MODELS, ESPECIALLY WITH AA
previous value of FREQ_MIN was: 0.000001, but this seemed to cause problems with some
of the 7-state secondary structure models with some rather exotic small toy test datasets,
on the other hand 0.001 caused problems with some of the 16-state secondary structure models
For some reason the frequency settings seem to be repeatedly causing numerical problems
*/
#define ITMAX 100
#define SHFT(a,b,c,d) (a)=(b);(b)=(c);(c)=(d);
#define SIGN(a,b) ((b) > 0.0 ? fabs(a) : -fabs(a))
#define ABS(x) (((x)<0) ? (-(x)) : (x))
#define MIN(x,y) (((x)<(y)) ? (x) : (y))
#define MAX(x,y) (((x)>(y)) ? (x) : (y))
#define NINT(x) ((int) ((x)>0 ? ((x)+0.5) : ((x)-0.5)))
#ifdef _USE_FPGA_LOG
extern double log_approx (double input);
#define LOG(x) log_approx(x)
#else
#define LOG(x) log(x)
#endif
#ifdef _USE_FPGA_EXP
extern double exp_approx (double x);
#define EXP(x) exp_approx(x)
#else
#define EXP(x) exp(x)
#endif
#define LOGF(x) logf(x)
#define PointGamma(prob,alpha,beta) PointChi2(prob,2.0*(alpha))/(2.0*(beta))
//#define programName "the phylip file parser for ExaML"
//#define programVersion "2.0.1"
//#define programDate "June 3 2014"
#define TREE_EVALUATION 0
#define BIG_RAPID_MODE 1
#define CALC_BIPARTITIONS 3
#define SPLIT_MULTI_GENE 4
#define CHECK_ALIGNMENT 5
#define PER_SITE_LL 6
#define PARSIMONY_ADDITION 7
#define CLASSIFY_ML 9
#define DISTANCE_MODE 11
#define GENERATE_BS 12
#define COMPUTE_ELW 13
#define BOOTSTOP_ONLY 14
#define COMPUTE_LHS 17
#define COMPUTE_BIPARTITION_CORRELATION 18
#define THOROUGH_PARSIMONY 19
#define COMPUTE_RF_DISTANCE 20
#define MORPH_CALIBRATOR 21
#define CONSENSUS_ONLY 22
#define MESH_TREE_SEARCH 23
#define FAST_SEARCH 24
#define MORPH_CALIBRATOR_PARSIMONY 25
#define SH_LIKE_SUPPORTS 28
#define M_GTRCAT 1
#define M_GTRGAMMA 2
#define M_BINCAT 3
#define M_BINGAMMA 4
#define M_PROTCAT 5
#define M_PROTGAMMA 6
#define M_32CAT 7
#define M_32GAMMA 8
#define M_64CAT 9
#define M_64GAMMA 10
#define DAYHOFF 0
#define DCMUT 1
#define JTT 2
#define MTREV 3
#define WAG 4
#define RTREV 5
#define CPREV 6
#define VT 7
#define BLOSUM62 8
#define MTMAM 9
#define LG 10
#define MTART 11
#define MTZOA 12
#define PMB 13
#define HIVB 14
#define HIVW 15
#define JTTDCMUT 16
#define FLU 17
#define STMTREV 18
#define AUTO 19
#define LG4M 20
#define LG4X 21
#define GTR 22 /* GTR always needs to be the last one */
#define NUM_PROT_MODELS 23
/* bipartition stuff */
#define BIPARTITIONS_ALL 0
#define GET_BIPARTITIONS_BEST 1
#define DRAW_BIPARTITIONS_BEST 2
#define BIPARTITIONS_BOOTSTOP 3
#define BIPARTITIONS_RF 4
/* bootstopping stuff */
#define BOOTSTOP_PERMUTATIONS 100
#define START_BSTOP_TEST 10
#define FC_THRESHOLD 99
#define FC_SPACING 50
#define FC_LOWER 0.99
#define FC_INIT 20
#define FREQUENCY_STOP 0
#define MR_STOP 1
#define MRE_STOP 2
#define MRE_IGN_STOP 3
#define MR_CONSENSUS 0
#define MRE_CONSENSUS 1
#define STRICT_CONSENSUS 2
/* bootstopping stuff end */
#define TIP_TIP 0
#define TIP_INNER 1
#define INNER_INNER 2
#define MIN_MODEL -1
#define BINARY_DATA 0
#define DNA_DATA 1
#define AA_DATA 2
#define SECONDARY_DATA 3
#define SECONDARY_DATA_6 4
#define SECONDARY_DATA_7 5
#define GENERIC_32 6
#define GENERIC_64 7
#define MAX_MODEL 8
#define SEC_6_A 0
#define SEC_6_B 1
#define SEC_6_C 2
#define SEC_6_D 3
#define SEC_6_E 4
#define SEC_7_A 5
#define SEC_7_B 6
#define SEC_7_C 7
#define SEC_7_D 8
#define SEC_7_E 9
#define SEC_7_F 10
#define SEC_16 11
#define SEC_16_A 12
#define SEC_16_B 13
#define SEC_16_C 14
#define SEC_16_D 15
#define SEC_16_E 16
#define SEC_16_F 17
#define SEC_16_I 18
#define SEC_16_J 19
#define SEC_16_K 20
#define ORDERED_MULTI_STATE 0
#define MK_MULTI_STATE 1
#define GTR_MULTI_STATE 2
#define CAT 0
#define GAMMA 1
#define GAMMA_I 2
typedef int boolean;
typedef struct {
double lh;
int tree;
double weight;
} elw;
struct ent
{
unsigned int *bitVector;
unsigned int *treeVector;
unsigned int amountTips;
int *supportVector;
unsigned int bipNumber;
unsigned int bipNumber2;
unsigned int supportFromTreeset[2];
struct ent *next;
};
typedef struct ent entry;
typedef unsigned int hashNumberType;
typedef unsigned int parsimonyNumber;
/*typedef uint_fast32_t parsimonyNumber;*/
#define PCF 32
/*
typedef uint64_t parsimonyNumber;
#define PCF 16
typedef unsigned char parsimonyNumber;
#define PCF 2
*/
typedef struct
{
hashNumberType tableSize;
entry **table;
hashNumberType entryCount;
}
hashtable;
struct stringEnt
{
int nodeNumber;
char *word;
struct stringEnt *next;
};
typedef struct stringEnt stringEntry;
typedef struct
{
hashNumberType tableSize;
stringEntry **table;
}
stringHashtable;
typedef struct
{
unsigned int parsimonyScore;
unsigned int parsimonyState;
}
parsimonyVector;
typedef struct ratec
{
double accumulatedSiteLikelihood;
double rate;
}
rateCategorize;
typedef struct
{
int tipCase;
int pNumber;
int qNumber;
int rNumber;
//double qz[NUM_BRANCHES];
//double rz[NUM_BRANCHES];
} traversalInfo;
typedef struct
{
traversalInfo *ti;
int count;
int functionType;
boolean traversalHasChanged;
boolean *executeModel;
double *parameterValues;
} traversalData;
struct noderec;
typedef struct epBrData
{
int *countThem;
int *executeThem;
unsigned int *parsimonyScores;
double *branches;
double *bootstrapBranches;
double *likelihoods;
double originalBranchLength;
char branchLabel[64];
int leftNodeNumber;
int rightNodeNumber;
int *leftScaling;
int *rightScaling;
parsimonyVector *leftParsimony;
parsimonyVector *rightParsimony;
//double branchLengths[NUM_BRANCHES];
double *left;
double *right;
int branchNumber;
} epaBranchData;
typedef struct
{
epaBranchData *epa;
unsigned int *vector;
int support;
struct noderec *oP;
struct noderec *oQ;
} branchInfo;
typedef struct
{
boolean valid;
int partitions;
int *partitionList;
}
linkageData;
typedef struct
{
int entries;
linkageData* ld;
}
linkageList;
typedef struct noderec
{
branchInfo *bInf;
// double z[NUM_BRANCHES];
#ifdef _BAYESIAN
//double z_tmp[NUM_BRANCHES];
#endif
struct noderec *next;
struct noderec *back;
hashNumberType hash;
int support;
int number;
char x;
}
node, *nodeptr;
typedef struct
{
double lh;
int number;
}
info;
typedef struct bInf {
double likelihood;
nodeptr node;
} bestInfo;
typedef struct iL {
bestInfo *list;
int n;
int valid;
} infoList;
typedef struct
{
int numsp;
int sites;
unsigned char **y;
unsigned char *y0;
int *wgt;
} rawdata;
typedef struct {
int *alias; /* site representing a pattern */
int *aliaswgt; /* weight by pattern */
int *rateCategory;
size_t endsite; /* # of sequence patterns */
double *patrat; /* rates per pattern */
double *patratStored;
} cruncheddata;
typedef struct {
int states;
int maxTipStates;
size_t lower;
size_t upper;
size_t width;
int dataType;
int protModels;
int autoProtModels;
int protFreqs;
int **expVector;
double **xVector;
size_t *xSpaceVector;
unsigned char **yVector;
char *partitionName;
double *sumBuffer;
double *gammaRates;
double *EIGN;
double *EV;
double *EI;
double *left;
double *right;
double *frequencies;
double *tipVector;
double *substRates;
double *perSiteRates;
double *wr;
double *wr2;
unsigned int *globalScaler;
double *globalScalerDouble;
int *wgt;
int *rateCategory;
int *symmetryVector;
int *frequencyGrouping;
boolean nonGTR;
boolean optimizeBaseFrequencies;
double alpha;
int gapVectorLength;
unsigned int *gapVector;
double *gapColumn;
int numberOfCategories;
} pInfo;
typedef struct
{
int left;
int right;
double likelihood;
} lhEntry;
typedef struct
{
int count;
int size;
lhEntry *entries;
} lhList;
typedef struct List_{
void *value;
struct List_ *next;
} List;
#define REARR_SETTING 1
#define FAST_SPRS 2
#define SLOW_SPRS 3
typedef struct {
int state;
unsigned int vLength;
int rearrangementsMax;
int rearrangementsMin;
int thoroughIterations;
int fastIterations;
int treeVectorLength;
int mintrav;
int maxtrav;
int bestTrav;
int Thorough;
int optimizeRateCategoryInvocations;
double accumulatedTime;
double startLH;
double lh;
double previousLh;
double difference;
double epsilon;
boolean impr;
boolean cutoff;
double tr_startLH;
double tr_endLH;
double tr_likelihood;
double tr_bestOfNode;
double tr_lhCutoff;
double tr_lhAVG;
double tr_lhDEC;
int tr_NumberOfCategories;
int tr_itCount;
int tr_doCutoff;
} checkPointState;
typedef struct {
double EIGN[19] __attribute__ ((aligned (BYTE_ALIGNMENT)));
double EV[400] __attribute__ ((aligned (BYTE_ALIGNMENT)));
double EI[380] __attribute__ ((aligned (BYTE_ALIGNMENT)));
double substRates[190];
double frequencies[20] ;
double tipVector[460] __attribute__ ((aligned (BYTE_ALIGNMENT)));
double fracchange[1];
double left[1600] __attribute__ ((aligned (BYTE_ALIGNMENT)));
double right[1600] __attribute__ ((aligned (BYTE_ALIGNMENT)));
} siteAAModels;
typedef struct {
boolean useGappedImplementation;
boolean saveMemory;
siteAAModels siteProtModel[2 * (NUM_PROT_MODELS - 2)];
boolean estimatePerSiteAA;
int *resample;
int numberOfBranches;
int numberOfTipsForInsertion;
int *inserts;
int branchCounter;
parsimonyNumber **parsimonyState_A;
parsimonyNumber **parsimonyState_C;
parsimonyNumber **parsimonyState_G;
parsimonyNumber **parsimonyState_T;
unsigned int *parsimonyScore;
int *ti;
unsigned int compressedWidth;
int numberOfTrees;
stringHashtable *nameHash;
pInfo *partitionData;
pInfo *initialPartitionData;
pInfo *extendedPartitionData;
int *dataVector;
int *initialDataVector;
int *extendedDataVector;
int *patternPosition;
int *columnPosition;
char *secondaryStructureInput;
boolean *executeModel;
double *perPartitionLH;
traversalData td[1];
int maxCategories;
double *wr;
double *wr2;
// double coreLZ[NUM_BRANCHES];
int modelNumber;
int numBranches;
int bootStopCriterion;
int consensusType;
double wcThreshold;
branchInfo *bInf;
int multiStateModel;
// boolean curvatOK[NUM_BRANCHES];
/* the stuff below is shared among DNA and AA, span does
not change depending on datatype */
double *fracchanges;
/* model stuff end */
unsigned char **yVector;
int secondaryStructureModel;
size_t originalCrunchedLength;
int fullSites;
int *originalModel;
int *originalDataVector;
int *originalWeights;
int *secondaryStructurePairs;
double *partitionContributions;
double fracchange;
double lhCutoff;
double lhAVG;
unsigned long lhDEC;
unsigned long itCount;
int numberOfInvariableColumns;
int weightOfInvariableColumns;
int rateHetModel;
double startLH;
double endLH;
double likelihood;
double *likelihoods;
node **nodep;
nodeptr nodeBaseAddress;
node *start;
int mxtips;
int *model;
int *constraintVector;
int numberOfSecondaryColumns;
boolean searchConvergenceCriterion;
int ntips;
int nextnode;
int NumberOfModels;
int parsimonyLength;
int checkPointCounter;
int treeID;
boolean bigCutoff;
// boolean partitionSmoothed[NUM_BRANCHES];
// boolean partitionConverged[NUM_BRANCHES];
boolean rooted;
boolean grouped;
boolean constrained;
boolean doCutoff;
boolean catOnly;
rawdata *rdta;
cruncheddata *cdta;
char **nameList;
char *tree_string;
char *tree0;
char *tree1;
int treeStringLength;
unsigned int bestParsimony;
double bestOfNode;
nodeptr removeNode;
nodeptr insertNode;
/*
double zqr[NUM_BRANCHES];
double currentZQR[NUM_BRANCHES];
double currentLZR[NUM_BRANCHES];
double currentLZQ[NUM_BRANCHES];
double currentLZS[NUM_BRANCHES];
double currentLZI[NUM_BRANCHES];
double lzs[NUM_BRANCHES];
double lzq[NUM_BRANCHES];
double lzr[NUM_BRANCHES];
double lzi[NUM_BRANCHES];
*/
int mr_thresh;
unsigned int **bitVectors;
unsigned int vLength;
hashtable *h;
} tree;
/***************************************************************/
typedef struct {
int partitionNumber;
int partitionLength;
} partitionType;
typedef struct
{
// double z[NUM_BRANCHES];
nodeptr p, q;
int cp, cq;
}
connectRELL, *connptrRELL;
typedef struct
{
connectRELL *connect;
int start;
double likelihood;
}
topolRELL;
typedef struct
{
int max;
topolRELL **t;
}
topolRELL_LIST;
/**************************************************************/
typedef struct conntyp {
// double z[NUM_BRANCHES]; /* branch length */
node *p, *q; /* parent and child sectors */
void *valptr; /* pointer to value of subtree */
int descend; /* pointer to first connect of child */
int sibling; /* next connect from same parent */
} connect, *connptr;
typedef struct {
double likelihood;
int initialTreeNumber;
connect *links; /* pointer to first connect (start) */
node *start;
int nextlink; /* index of next available connect */
/* tr->start = tpl->links->p */
int ntips;
int nextnode;
int scrNum; /* position in sorted list of scores */
int tplNum; /* position in sorted list of trees */
} topol;
typedef struct {
double best; /* highest score saved */
double worst; /* lowest score saved */
topol *start; /* starting tree for optimization */
topol **byScore;
topol **byTopol;
int nkeep; /* maximum topologies to save */
int nvalid; /* number of topologies saved */
int ninit; /* number of topologies initialized */
int numtrees; /* number of alternatives tested */
boolean improved;
} bestlist;
typedef struct {
int categories;
int model;
int bestTrav;
int max_rearrange;
int stepwidth;
int initial;
boolean initialSet;
int mode;
long boot;
long rapidBoot;
boolean bootstrapBranchLengths;
boolean restart;
boolean useWeightFile;
boolean useMultipleModel;
boolean constraint;
boolean grouping;
boolean randomStartingTree;
boolean useInvariant;
int protEmpiricalFreqs;
int proteinMatrix;
int checkpoints;
int startingTreeOnly;
int multipleRuns;
long parsimonySeed;
boolean perGeneBranchLengths;
boolean likelihoodTest;
boolean permuteTreeoptimize;
boolean allInOne;
boolean generateBS;
boolean bootStopping;
boolean useExcludeFile;
boolean userProteinModel;
boolean computeELW;
boolean computeDistance;
boolean thoroughInsertion;
boolean compressPatterns;
boolean useSecondaryStructure;
double likelihoodEpsilon;
double gapyness;
int similarityFilterMode;
double *externalAAMatrix;
boolean readTaxaOnly;
int meshSearch;
boolean veryFast;
boolean useCheckpoint;
boolean leaveDropMode;
int slidingWindowSize;
boolean writeBinaryFile;
boolean readBinaryFile;
#ifdef _BAYESIAN
boolean bayesian;
#endif
} analdef;
typedef struct
{
int leftLength;
int rightLength;
int eignLength;
int evLength;
int eiLength;
int substRatesLength;
int frequenciesLength;
int tipVectorLength;
int symmetryVectorLength;
int frequencyGroupingLength;
boolean nonGTR;
boolean optimizeBaseFrequencies;
unsigned char undetermined;
const char *inverseMeaning;
int states;
boolean smoothFrequencies;
const unsigned int *bitVector;
} partitionLengths;
/****************************** FUNCTIONS ****************************************************/
extern void computePlacementBias(tree *tr, analdef *adef);
extern int lookupWord(char *s, stringHashtable *h);
extern void getDataTypeString(tree *tr, int model, char typeOfData[1024]);
extern unsigned int genericBitCount(unsigned int* bitVector, unsigned int bitVectorLength);
extern int countTips(nodeptr p, int numsp);
extern entry *initEntry(void);
extern void computeRogueTaxa(tree *tr, char* treeSetFileName, analdef *adef);
extern unsigned int precomputed16_bitcount(unsigned int n);
extern size_t discreteRateCategories(int rateHetModel);
extern partitionLengths * getPartitionLengths(pInfo *p);
extern boolean getSmoothFreqs(int dataType);
extern const unsigned int *getBitVector(int dataType);
extern unsigned char getUndetermined(int dataType);
extern int getStates(int dataType);
extern char getInverseMeaning(int dataType, unsigned char state);
extern double gettime ( void );
extern int gettimeSrand ( void );
extern double randum ( long *seed );
extern void getxnode ( nodeptr p );
extern void hookup ( nodeptr p, nodeptr q, double *z, int numBranches);
extern void hookupDefault ( nodeptr p, nodeptr q, int numBranches);
extern boolean whitechar ( int ch );
extern void errorExit ( int e );
extern void printResult ( tree *tr, analdef *adef, boolean finalPrint );
extern void printBootstrapResult ( tree *tr, analdef *adef, boolean finalPrint );
extern void printBipartitionResult ( tree *tr, analdef *adef, boolean finalPrint );
extern void printLog ( tree *tr, analdef *adef, boolean finalPrint );
extern void printStartingTree ( tree *tr, analdef *adef, boolean finalPrint );
extern void writeInfoFile ( analdef *adef, tree *tr, double t );
extern int main ( int argc, char *argv[] );
extern void calcBipartitions ( tree *tr, analdef *adef, char *bestTreeFileName, char *bootStrapFileName );
extern void initReversibleGTR (tree *tr, int model);
extern double LnGamma ( double alpha );
extern double IncompleteGamma ( double x, double alpha, double ln_gamma_alpha );
extern double PointNormal ( double prob );
extern double PointChi2 ( double prob, double v );
extern void makeGammaCats (double alpha, double *gammaRates, int K);
extern void initModel ( tree *tr, rawdata *rdta, cruncheddata *cdta, analdef *adef );
extern void doAllInOne ( tree *tr, analdef *adef );
extern void classifyML(tree *tr, analdef *adef);
extern void doBootstrap ( tree *tr, analdef *adef, rawdata *rdta, cruncheddata *cdta );
extern void doInference ( tree *tr, analdef *adef, rawdata *rdta, cruncheddata *cdta );
extern void resetBranches ( tree *tr );
extern void modOpt ( tree *tr, analdef *adef , double likelihoodEpsilon);
extern void parsePartitions ( analdef *adef, rawdata *rdta, tree *tr);
extern void computeBOOTRAPID (tree *tr, analdef *adef, long *radiusSeed);
extern void optimizeRAPID ( tree *tr, analdef *adef );
extern void thoroughOptimization ( tree *tr, analdef *adef, topolRELL_LIST *rl, int index );
extern int treeOptimizeThorough ( tree *tr, int mintrav, int maxtrav);
extern int checker ( tree *tr, nodeptr p );
extern int randomInt ( int n );
extern void makePermutation ( int *perm, int n, analdef *adef );
extern boolean tipHomogeneityChecker ( tree *tr, nodeptr p, int grouping );
extern void makeRandomTree ( tree *tr, analdef *adef );
extern void nodeRectifier ( tree *tr );
extern void makeParsimonyTreeThorough(tree *tr, analdef *adef);
extern void makeParsimonyTree ( tree *tr, analdef *adef );
extern void makeParsimonyTreeFastDNA(tree *tr, analdef *adef);
extern void makeParsimonyTreeIncomplete ( tree *tr, analdef *adef );
extern void makeParsimonyInsertions(tree *tr, nodeptr startNodeQ, nodeptr startNodeR);
extern FILE *myfopen(const char *path, const char *mode);
extern boolean initrav ( tree *tr, nodeptr p );
extern void initravPartition ( tree *tr, nodeptr p, int model );
extern boolean update ( tree *tr, nodeptr p );
extern boolean smooth ( tree *tr, nodeptr p );
extern boolean smoothTree ( tree *tr, int maxtimes );
extern boolean localSmooth ( tree *tr, nodeptr p, int maxtimes );
extern boolean localSmoothMulti(tree *tr, nodeptr p, int maxtimes, int model);
extern void initInfoList ( int n );
extern void freeInfoList ( void );
extern void insertInfoList ( nodeptr node, double likelihood );
extern boolean smoothRegion ( tree *tr, nodeptr p, int region );
extern boolean regionalSmooth ( tree *tr, nodeptr p, int maxtimes, int region );
extern nodeptr removeNodeBIG ( tree *tr, nodeptr p, int numBranches);
extern nodeptr removeNodeRestoreBIG ( tree *tr, nodeptr p );
extern boolean insertBIG ( tree *tr, nodeptr p, nodeptr q, int numBranches);
extern boolean insertRestoreBIG ( tree *tr, nodeptr p, nodeptr q );
extern boolean testInsertBIG ( tree *tr, nodeptr p, nodeptr q );
extern void addTraverseBIG ( tree *tr, nodeptr p, nodeptr q, int mintrav, int maxtrav );
extern int rearrangeBIG ( tree *tr, nodeptr p, int mintrav, int maxtrav );
extern void traversalOrder ( nodeptr p, int *count, nodeptr *nodeArray );
extern double treeOptimizeRapid ( tree *tr, int mintrav, int maxtrav, analdef *adef, bestlist *bt);
extern boolean testInsertRestoreBIG ( tree *tr, nodeptr p, nodeptr q );
extern void restoreTreeFast ( tree *tr );
extern int determineRearrangementSetting ( tree *tr, analdef *adef, bestlist *bestT, bestlist *bt );
extern void computeBIGRAPID ( tree *tr, analdef *adef, boolean estimateModel);
extern boolean treeEvaluate ( tree *tr, double smoothFactor );
extern boolean treeEvaluatePartition ( tree *tr, double smoothFactor, int model );
extern void meshTreeSearch(tree *tr, analdef *adef, int thorough);
extern void initTL ( topolRELL_LIST *rl, tree *tr, int n );
extern void freeTL ( topolRELL_LIST *rl);
extern void restoreTL ( topolRELL_LIST *rl, tree *tr, int n );
extern void resetTL ( topolRELL_LIST *rl );
extern void saveTL ( topolRELL_LIST *rl, tree *tr, int index );
extern int saveBestTree (bestlist *bt, tree *tr);
extern int recallBestTree (bestlist *bt, int rank, tree *tr);
extern int initBestTree ( bestlist *bt, int newkeep, int numsp );
extern void resetBestTree ( bestlist *bt );
extern boolean freeBestTree ( bestlist *bt );
extern char *Tree2String ( char *treestr, tree *tr, nodeptr p, boolean printBranchLengths, boolean printNames, boolean printLikelihood,
boolean rellTree, boolean finalPrint, int perGene, boolean branchLabelSupport, boolean printSHSupport);
extern void printTreePerGene(tree *tr, analdef *adef, char *fileName, char *permission);
extern int treeReadLen (FILE *fp, tree *tr, boolean readBranches, boolean readNodeLabels, boolean topologyOnly);
extern void treeReadTopologyString(char *treeString, tree *tr);
extern boolean treeReadLenMULT ( FILE *fp, tree *tr, analdef *adef );
extern void getStartingTree ( tree *tr);
extern double treeLength(tree *tr, int model);
extern void computeBootStopOnly(tree *tr, char *bootStrapFileName, analdef *adef);
extern boolean bootStop(tree *tr, hashtable *h, int numberOfTrees, double *pearsonAverage, unsigned int **bitVectors, int treeVectorLength, unsigned int vectorLength);
extern void computeConsensusOnly(tree *tr, char* treeSetFileName, analdef *adef);
extern double evaluatePartialGeneric (tree *, int i, double ki, int _model);
extern void evaluateGeneric (tree *tr, nodeptr p, boolean fullTraversal);
extern void newviewGeneric (tree *tr, nodeptr p, boolean masked);
extern void newviewGenericMulti (tree *tr, nodeptr p, int model);
extern void makenewzGeneric(tree *tr, nodeptr p, nodeptr q, double *z0, int maxiter, double *result, boolean mask);
extern void makenewzGenericDistance(tree *tr, int maxiter, double *z0, double *result, int taxon1, int taxon2);
extern double evaluatePartitionGeneric (tree *tr, nodeptr p, int model);
extern void newviewPartitionGeneric (tree *tr, nodeptr p, int model);
extern double evaluateGenericVector (tree *tr, nodeptr p);
extern void categorizeGeneric (tree *tr, nodeptr p);
extern double makenewzPartitionGeneric(tree *tr, nodeptr p, nodeptr q, double z0, int maxiter, int model);
extern boolean isTip(int number, int maxTips);
extern void computeTraversalInfo(nodeptr p, traversalInfo *ti, int *counter, int maxTips, int numBranches, boolean partialTraversal);
extern void newviewIterative(tree *tr, int startIndex);
extern void evaluateIterative(tree *);
extern void *malloc_aligned( size_t size);
extern void storeExecuteMaskInTraversalDescriptor(tree *tr);
extern void storeValuesInTraversalDescriptor(tree *tr, double *value);
extern void myBinFwrite(const void *ptr, size_t size, size_t nmemb);
extern void myBinFread(void *ptr, size_t size, size_t nmemb);
extern void makenewzIterative(tree *);
extern void execCore(tree *, volatile double *dlnLdlz, volatile double *d2lnLdlz2);
extern void determineFullTraversal(nodeptr p, tree *tr);
/*extern void optRateCat(tree *, int i, double lower_spacing, double upper_spacing, double *lhs);*/
extern unsigned int evaluateParsimonyIterative(tree *);
extern void newviewParsimonyIterative(tree *);
extern unsigned int evaluateParsimonyIterativeFast(tree *);
extern void newviewParsimonyIterativeFast(tree *);
extern unsigned int evaluatePerSiteParsimony(tree *tr, nodeptr p, unsigned int *siteParsimony);
extern void initravParsimonyNormal(tree *tr, nodeptr p);
extern double evaluateGenericInitravPartition(tree *tr, nodeptr p, int model);
extern void evaluateGenericVectorIterative(tree *, int startIndex, int endIndex);
extern void categorizeIterative(tree *, int startIndex, int endIndex);
extern void fixModelIndices(tree *tr, int endsite, boolean fixRates);
extern void calculateModelOffsets(tree *tr);
extern void gammaToCat(tree *tr);
extern void catToGamma(tree *tr, analdef *adef);
extern void handleExcludeFile(tree *tr, analdef *adef, rawdata *rdta);
extern nodeptr findAnyTip(nodeptr p, int numsp);
extern void parseProteinModel(analdef *adef);
extern void computeNextReplicate(tree *tr, long *seed, int *originalRateCategories, int *originalInvariant, boolean isRapid, boolean fixRates);
/*extern void computeNextReplicate(tree *tr, analdef *adef, int *originalRateCategories, int *originalInvariant);*/
extern void putWAG(double *ext_initialRates);
extern void reductionCleanup(tree *tr, int *originalRateCategories, int *originalInvariant);
extern void parseSecondaryStructure(tree *tr, analdef *adef, int sites);
extern void printPartitions(tree *tr);
extern void compareBips(tree *tr, char *bootStrapFileName, analdef *adef);
extern void computeRF(tree *tr, char *bootStrapFileName, analdef *adef);
extern unsigned int **initBitVector(tree *tr, unsigned int *vectorLength);
extern hashtable *copyHashTable(hashtable *src, unsigned int vectorLength);
extern hashtable *initHashTable(unsigned int n);
extern void cleanupHashTable(hashtable *h, int state);
extern double convergenceCriterion(hashtable *h, int mxtips);
extern void freeBitVectors(unsigned int **v, int n);
extern void freeHashTable(hashtable *h);
extern void printBothOpen(const char* format, ... );
extern void printBothOpenMPI(const char* format, ... );
extern void initRateMatrix(tree *tr);
extern void bitVectorInitravSpecial(unsigned int **bitVectors, nodeptr p, int numsp, unsigned int vectorLength, hashtable *h, int treeNumber, int function, branchInfo *bInf,
int *countBranches, int treeVectorLength, boolean traverseOnly, boolean computeWRF);
extern int getIncrement(tree *tr, int model);
extern void fastSearch(tree *tr, analdef *adef, rawdata *rdta, cruncheddata *cdta);
extern void shSupports(tree *tr, analdef *adef, rawdata *rdta, cruncheddata *cdta);
extern FILE *getNumberOfTrees(tree *tr, char *fileName, analdef *adef);
extern void writeBinaryModel(tree *tr);
extern void readBinaryModel(tree *tr);
extern void treeEvaluateRandom (tree *tr, double smoothFactor);
extern void treeEvaluateProgressive(tree *tr);
extern void testGapped(tree *tr);
extern boolean issubset(unsigned int* bipA, unsigned int* bipB, unsigned int vectorLen);
extern boolean compatible(entry* e1, entry* e2, unsigned int bvlen);
extern int *permutationSH(tree *tr, int nBootstrap, long _randomSeed);
extern void updatePerSiteRates(tree *tr, boolean scaleRates);
extern void restart(tree *tr);
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