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KEEL-dataset - data set description
dataset/images/musk2.jpg
Musk 2 data set


Main Description

This section describes main characteristics of the musk2 data set and its attributes:

General information

Musk 2 data set
TypeMulti instanceOriginReal world
Features 167(Real / Integer / Nominal)(166 / 0 / 1)
Instances6598 Classes2
Missing values?No

Attribute description

AttributeDomainAttributeDomainAttributeDomain
Molecule_name{MUSK-jf66, ... , MUSK-331}F56[-279.0, 214.0]F112[-266.0, 214.0]
F1[-31.0, 292.0]F57[-170.0, 229.0]F113[-224.0, 194.0]
F2[-199.0, 95.0]F58[-178.0, 113.0]F114[-204.0, 180.0]
F3[-167.0, 81.0]F59[-172.0, 200.0]F115[-250.0, 216.0]
F4[-114.0, 161.0]F60[-250.0, 200.0]F116[-257.0, 253.0]
F5[-118.0, 325.0]F61[-102.0, 254.0]F117[-103.0, 315.0]
F6[-183.0, 200.0]F62[-196.0, 180.0]F118[-212.0, 156.0]
F7[-171.0, 220.0]F63[-100.0, 284.0]F119[-196.0, 209.0]
F8[-225.0, 320.0]F64[-195.0, 225.0]F120[-201.0, 152.0]
F9[-245.0, 147.0]F65[-165.0, 112.0]F121[-121.0, 267.0]
F10[-286.0, 231.0]F66[-9.0, 315.0]F122[-117.0, 258.0]
F11[-328.0, 176.0]F67[-167.0, 234.0]F123[-129.0, 276.0]
F12[-321.0, 184.0]F68[-195.0, 149.0]F124[-127.0, 227.0]
F13[-305.0, 195.0]F69[-134.0, 232.0]F125[-144.0, 299.0]
F14[-342.0, 158.0]F70[-191.0, 158.0]F126[-69.0, 308.0]
F15[-294.0, 172.0]F71[-174.0, 86.0]F127[-286.0, 219.0]
F16[-327.0, 80.0]F72[-152.0, 99.0]F128[-221.0, 241.0]
F17[-224.0, 138.0]F73[-324.0, 181.0]F129[-307.0, 206.0]
F18[-308.0, 189.0]F74[-333.0, 172.0]F130[-189.0, 122.0]
F19[-286.0, 225.0]F75[-274.0, 203.0]F131[-123.0, 281.0]
F20[-252.0, 227.0]F76[-195.0, 21.0]F132[-140.0, 255.0]
F21[-295.0, 194.0]F77[-259.0, 156.0]F133[-319.0, 176.0]
F22[-185.0, 190.0]F78[-313.0, 235.0]F134[-338.0, 169.0]
F23[-253.0, 213.0]F79[-306.0, 193.0]F135[-336.0, 219.0]
F24[-76.0, 317.0]F80[-202.0, 309.0]F136[-196.0, 125.0]
F25[-100.0, 277.0]F81[-255.0, 198.0]F137[-197.0, 186.0]
F26[-242.0, 183.0]F82[-175.0, 201.0]F138[-199.0, 130.0]
F27[-205.0, 164.0]F83[-299.0, 175.0]F139[-243.0, 202.0]
F28[-166.0, 145.0]F84[-98.0, 273.0]F140[-283.0, 203.0]
F29[-142.0, 174.0]F85[-220.0, 193.0]F141[-290.0, 188.0]
F30[-162.0, 266.0]F86[-203.0, 194.0]F142[-185.0, 184.0]
F31[-117.0, 309.0]F87[-207.0, 109.0]F143[-157.0, 239.0]
F32[-143.0, 310.0]F88[-213.0, 172.0]F144[-171.0, 208.0]
F33[-139.0, 207.0]F89[-111.0, 152.0]F145[-179.0, 213.0]
F34[-279.0, 160.0]F90[-157.0, 269.0]F146[-106.0, 261.0]
F35[-160.0, 220.0]F91[-202.0, 235.0]F147[-136.0, 172.0]
F36[-7.0, 324.0]F92[-16.0, 306.0]F148[-200.0, 130.0]
F37[-175.0, 147.0]F93[-125.0, 223.0]F149[-213.0, 117.0]
F38[-190.0, 187.0]F94[-328.0, 184.0]F150[-190.0, 185.0]
F39[-148.0, 107.0]F95[-119.0, 238.0]F151[-140.0, 244.0]
F40[-180.0, 194.0]F96[-69.0, 347.0]F152[-128.0, 153.0]
F41[-188.0, 90.0]F97[-191.0, 165.0]F153[-114.0, 211.0]
F42[-150.0, 367.0]F98[-190.0, 203.0]F154[-173.0, 120.0]
F43[-295.0, 225.0]F99[-157.0, 40.0]F155[-143.0, 379.0]
F44[-343.0, 198.0]F100[-156.0, 237.0]F156[-198.0, 153.0]
F45[-310.0, 147.0]F101[-209.0, 91.0]F157[-257.0, 145.0]
F46[-340.0, 161.0]F102[-33.0, 348.0]F158[-328.0, 94.0]
F47[-159.0, 110.0]F103[-299.0, 173.0]F159[-219.0, 179.0]
F48[-290.0, 179.0]F104[-324.0, 191.0]F160[-136.0, 192.0]
F49[-265.0, 273.0]F105[-319.0, 154.0]F161[-120.0, 411.0]
F50[-279.0, 215.0]F106[-284.0, 212.0]F162[-69.0, 355.0]
F51[-326.0, 172.0]F107[-200.0, 159.0]F163[73.0, 625.0]
F52[-206.0, 177.0]F108[-292.0, 167.0]F164[-289.0, 295.0]
F53[-206.0, 169.0]F109[-249.0, 200.0]F165[-428.0, 168.0]
F54[-147.0, 335.0]F110[-291.0, 141.0]F166[-471.0, 367.0]
F55[-112.0, 269.0]F111[-250.0, 209.0]Class{0, 1}

Additional information

The problem consists of determining whether a drug molecule will bind strongly to a target protein. Each molecule may adopt a wide range of shapes or conformations. A positive molecule has at least one shape that can bind well (although it is not known which one) and a negative molecule means none of its shapes can make the molecule bind well. This problem could be represented in a very natural way in MIL settings: each molecule would be a bag and the conformations it can adopt would be the instances in that bag.



Main Files and additional references

In this section you can download some files related to the musk2 data set:

  • The complete data set already formatted in KEEL format can be downloaded from herezip.gif.
  • A copy of the data set already partitioned by means of a 10-folds cross validation procedure can be downloaded from herezip.gif.
  • The header file associated to this data set can be downloaded from heretxt.png.

 
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