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AAMOE2D

2D Descriptors for 20 Amino Acids calculated by MOE 2011.10

Bundled with Rcpi · exported, loads via data()

Class
data.frame
Dimensions
20 × 148
Missing
0
Format
rda · gzip
version 2 · 14 KB
File
data/AAMOE2D.rda
Fingerprint
afc716ca
Source
Source not stated
About this object
A table with named columnsA bordered table: a header band ruled off from the body with an empty slot over each column where its name goes, and rows of cells under it that share every edge. Nothing is in any of them.

Equal-length columns presented as a table, R's standard rectangular format. R object catalogue

Declared attributes
Row names
Yes
Columns
Column
Type
Distinct
Missing
Summary
apol
numeric
19
0
9.558 – 31.1655mean 19.83
Min.
9.558
1st Qu.
16.4142
Median
19.5915
Mean
19.8338
3rd Qu.
22.374
Max.
31.1655
Std. dev
5.3084
Skewness
0.1288
Kurtosis
-0.6143
a_acc
integer
3
0
3 – 5mean 3.65
Min.
3
1st Qu.
3
Median
3.5
Mean
3.65
3rd Qu.
4
Max.
5
Std. dev
0.7452
Skewness
0.5964
Kurtosis
-1.077
a_aro
integer
4
0
0 – 9mean 1.3
Min.
0
1st Qu.
0
Median
0
Mean
1.3
3rd Qu.
0
Max.
9
Std. dev
2.7549
Skewness
1.625
Kurtosis
1.101
Zeros
16
a_count
integer
12
0
10 – 27mean 19.2
Min.
10
1st Qu.
16.75
Median
19.5
Mean
19.2
3rd Qu.
22.25
Max.
27
Std. dev
4.5143
Skewness
-0.1372
Kurtosis
-0.8915
a_don
integer
3
0
3 – 5mean 3.75
Min.
3
1st Qu.
3
Median
4
Mean
3.75
3rd Qu.
4
Max.
5
Std. dev
0.7864
Skewness
0.4241
Kurtosis
-1.347
a_heavy
integer
10
0
5 – 15mean 9.35
Min.
5
1st Qu.
8
Median
9
Mean
9.35
3rd Qu.
10.25
Max.
15
Std. dev
2.4121
Skewness
0.4206
Kurtosis
-0.2556
Outliers
10 low · 1 high
a_hyd
integer
7
0
1 – 10mean 4.1
Min.
1
1st Qu.
2
Median
4
Mean
4.1
3rd Qu.
5
Max.
10
Std. dev
2.3373
Skewness
0.9665
Kurtosis
0.1345
Outliers
10 low · 1 high
a_IC
numeric
19
0
17.6096 – 43.3987mean 31.75
Min.
17.6096
1st Qu.
27.989
Median
32.492
Mean
31.7475
3rd Qu.
35.5053
Max.
43.3987
Std. dev
6.6149
Skewness
-0.136
Kurtosis
-0.5218
a_ICM
numeric
18
0
1.4769 – 1.9212mean 1.668
Min.
1.4769
1st Qu.
1.5908
Median
1.6692
Mean
1.6681
3rd Qu.
1.7473
Max.
1.9212
Std. dev
0.1181
Skewness
0.0738
Kurtosis
-0.8266
a_nC
integer
7
0
2 – 11mean 5.35
Min.
2
1st Qu.
4
Median
5
Mean
5.35
3rd Qu.
6
Max.
11
Std. dev
2.2308
Skewness
0.8777
Kurtosis
0.2354
Outliers
10 low · 1 high
a_nH
integer
9
0
5 – 14mean 9.85
Min.
5
1st Qu.
7.75
Median
9.5
Mean
9.85
3rd Qu.
11.25
Max.
14
Std. dev
2.5808
Skewness
0.0175
Kurtosis
-1.141
a_nN
integer
4
0
1 – 4mean 1.45
Min.
1
1st Qu.
1
Median
1
Mean
1.45
3rd Qu.
2
Max.
4
Std. dev
0.8256
Skewness
1.75
Kurtosis
2.273
Outliers
10 low · 1 high
balabanJ
numeric
16
0
1.89 – 3.5998mean 2.998
Min.
1.89
1st Qu.
2.5676
Median
3.1947
Mean
2.9981
3rd Qu.
3.4029
Max.
3.5998
Std. dev
0.5366
Skewness
-0.7847
Kurtosis
-1.014
BCUT_PEOE_0
numeric
20
0
-2.6615 – -2.2765mean -2.508
Min.
-2.6615
1st Qu.
-2.5608
Median
-2.4806
Mean
-2.508
3rd Qu.
-2.4501
Max.
-2.2765
Std. dev
0.0946
Skewness
0.1514
Kurtosis
-0.1317
Outliers
10 low · 1 high
BCUT_PEOE_1
numeric
20
0
-0.6751 – -0.3258mean -0.5209
Min.
-0.6751
1st Qu.
-0.5946
Median
-0.5289
Mean
-0.5209
3rd Qu.
-0.4563
Max.
-0.3258
Std. dev
0.0839
Skewness
0.3213
Kurtosis
-0.4376
BCUT_PEOE_2
numeric
20
0
0.3035 – 0.7374mean 0.5077
Min.
0.3035
1st Qu.
0.415
Median
0.4555
Mean
0.5077
3rd Qu.
0.6213
Max.
0.7374
Std. dev
0.1212
Skewness
0.2986
Kurtosis
-1.249
BCUT_PEOE_3
numeric
20
0
2.2955 – 2.69mean 2.545
Min.
2.2955
1st Qu.
2.5045
Median
2.5461
Mean
2.5449
3rd Qu.
2.598
Max.
2.69
Std. dev
0.0848
Skewness
-0.9218
Kurtosis
1.462
Outliers
11 low · 0 high
BCUT_SLOGP_0
numeric
20
0
-2.7916 – -2.6324mean -2.733
Min.
-2.7916
1st Qu.
-2.7497
Median
-2.7381
Mean
-2.733
3rd Qu.
-2.7306
Max.
-2.6324
Std. dev
0.0374
Skewness
1.256
Kurtosis
1.4
Outliers
41 low · 3 high
BCUT_SLOGP_1
numeric
20
0
-0.6329 – -0.2368mean -0.4868
Min.
-0.6329
1st Qu.
-0.5309
Median
-0.4995
Mean
-0.4868
3rd Qu.
-0.4215
Max.
-0.2368
Std. dev
0.0944
Skewness
0.6946
Kurtosis
0.3017
Outliers
10 low · 1 high
BCUT_SLOGP_2
numeric
20
0
0.3548 – 0.798mean 0.4875
Min.
0.3548
1st Qu.
0.3816
Median
0.4112
Mean
0.4875
3rd Qu.
0.5716
Max.
0.798
Std. dev
0.1484
Skewness
0.8873
Kurtosis
-0.7525
BCUT_SLOGP_3
numeric
20
0
2.0274 – 2.6874mean 2.465
Min.
2.0274
1st Qu.
2.3638
Median
2.4439
Mean
2.4646
3rd Qu.
2.5978
Max.
2.6874
Std. dev
0.1676
Skewness
-0.6302
Kurtosis
0.0675
BCUT_SMR_0
numeric
20
0
-2.4201 – -2.025mean -2.268
Min.
-2.4201
1st Qu.
-2.32
Median
-2.2294
Mean
-2.2682
3rd Qu.
-2.2197
Max.
-2.025
Std. dev
0.0955
Skewness
0.2952
Kurtosis
0.0638
Outliers
10 low · 1 high
BCUT_SMR_1
numeric
20
0
-0.5342 – -0.1457mean -0.3451
Min.
-0.5342
1st Qu.
-0.4112
Median
-0.3263
Mean
-0.3451
3rd Qu.
-0.2682
Max.
-0.1457
Std. dev
0.0983
Skewness
-0.0946
Kurtosis
-0.8355
BCUT_SMR_2
numeric
20
0
0.4947 – 0.8764mean 0.6392
Min.
0.4947
1st Qu.
0.566
Median
0.6014
Mean
0.6392
3rd Qu.
0.7345
Max.
0.8764
Std. dev
0.1175
Skewness
0.4779
Kurtosis
-1.121
BCUT_SMR_3
numeric
20
0
2.5274 – 2.9387mean 2.78
Min.
2.5274
1st Qu.
2.7469
Median
2.7725
Mean
2.7801
3rd Qu.
2.8328
Max.
2.9387
Std. dev
0.0876
Skewness
-0.7993
Kurtosis
1.307
Outliers
11 low · 0 high
bpol
numeric
16
0
5.764 – 15.6029mean 11.58
Min.
5.764
1st Qu.
9.9381
Median
11.8225
Mean
11.5847
3rd Qu.
14.1848
Max.
15.6029
Std. dev
2.6995
Skewness
-0.3359
Kurtosis
-0.8927
b_1rotN
integer
5
0
1 – 5mean 2.85
Min.
1
1st Qu.
2
Median
3
Mean
2.85
3rd Qu.
3.25
Max.
5
Std. dev
1.1821
Skewness
0.0913
Kurtosis
-0.818
b_1rotR
numeric
13
0
0.125 – 0.5556mean 0.3327
Min.
0.125
1st Qu.
0.25
Median
0.3333
Mean
0.3327
3rd Qu.
0.3924
Max.
0.5556
Std. dev
0.112
Skewness
0.132
Kurtosis
-0.8952
b_ar
integer
4
0
0 – 10mean 1.35
Min.
0
1st Qu.
0
Median
0
Mean
1.35
3rd Qu.
0
Max.
10
Std. dev
2.9069
Skewness
1.746
Kurtosis
1.737
Zeros
16
b_count
integer
14
0
9 – 28mean 18.5
Min.
9
1st Qu.
15.75
Median
18.5
Mean
18.5
3rd Qu.
21.5
Max.
28
Std. dev
4.8068
Skewness
-0.0122
Kurtosis
-0.7763
b_heavy
integer
10
0
4 – 16mean 8.65
Min.
4
1st Qu.
7
Median
8
Mean
8.65
3rd Qu.
9.5
Max.
16
Std. dev
2.8335
Skewness
0.7605
Kurtosis
0.2755
Outliers
10 low · 1 high
b_rotN
integer
5
0
1 – 5mean 2.85
Min.
1
1st Qu.
2
Median
3
Mean
2.85
3rd Qu.
3.25
Max.
5
Std. dev
1.1821
Skewness
0.0913
Kurtosis
-0.818
b_rotR
numeric
13
0
0.125 – 0.5556mean 0.3327
Min.
0.125
1st Qu.
0.25
Median
0.3333
Mean
0.3327
3rd Qu.
0.3924
Max.
0.5556
Std. dev
0.112
Skewness
0.132
Kurtosis
-0.8952
b_single
integer
12
0
8 – 23mean 15.9
Min.
8
1st Qu.
13.75
Median
16
Mean
15.9
3rd Qu.
17.25
Max.
23
Std. dev
3.7262
Skewness
-0.0298
Kurtosis
-0.5235
Outliers
21 low · 1 high
chi0
numeric
14
0
4.2845 – 10.8365mean 7.47
Min.
4.2845
1st Qu.
6.5448
Median
7.4392
Mean
7.4701
3rd Qu.
8.1766
Max.
10.8365
Std. dev
1.6132
Skewness
0.0974
Kurtosis
-0.5197
Outliers
10 low · 1 high
chi0v
numeric
19
0
2.6399 – 8.104mean 5.32
Min.
2.6399
1st Qu.
4.5577
Median
5.3449
Mean
5.3202
3rd Qu.
5.9742
Max.
8.104
Std. dev
1.2949
Skewness
0.0089
Kurtosis
-0.3969
Outliers
10 low · 1 high
chi0v_C
numeric
16
0
1.2071 – 6.1712mean 3.33
Min.
1.2071
1st Qu.
2.2845
Median
3.3189
Mean
3.3304
3rd Qu.
4.0198
Max.
6.1712
Std. dev
1.2785
Skewness
0.3712
Kurtosis
-0.6508
chi0_C
numeric
15
0
1.2845 – 7.1294mean 3.558
Min.
1.2845
1st Qu.
2.4392
Median
3.4225
Mean
3.558
3rd Qu.
4.0971
Max.
7.1294
Std. dev
1.4914
Skewness
0.6832
Kurtosis
-0.2083
Outliers
10 low · 1 high
chi1
numeric
15
0
2.2701 – 7.1815mean 4.301
Min.
2.2701
1st Qu.
3.5534
Median
4.064
Mean
4.3014
3rd Qu.
4.8101
Max.
7.1815
Std. dev
1.1935
Skewness
0.5371
Kurtosis
-0.1816
Outliers
10 low · 1 high
chi1v
numeric
20
0
1.1895 – 4.7162mean 2.857
Min.
1.1895
1st Qu.
2.2881
Median
2.7856
Mean
2.8573
3rd Qu.
3.4185
Max.
4.7162
Std. dev
0.8722
Skewness
0.1312
Kurtosis
-0.6049
chi1v_C
numeric
16
0
0.3536 – 3.4165mean 1.637
Min.
0.3536
1st Qu.
1.0505
Median
1.5505
Mean
1.6371
3rd Qu.
2.2127
Max.
3.4165
Std. dev
0.8214
Skewness
0.5173
Kurtosis
-0.7115
chi1_C
numeric
16
0
0.4082 – 4.5412mean 1.847
Min.
0.4082
1st Qu.
1.1498
Median
1.6498
Mean
1.8473
3rd Qu.
2.2573
Max.
4.5412
Std. dev
1.1098
Skewness
1.059
Kurtosis
0.1575
Outliers
20 low · 2 high
density
numeric
19
0
0.7097 – 0.9136mean 0.8034
Min.
0.7097
1st Qu.
0.7466
Median
0.806
Mean
0.8034
3rd Qu.
0.8624
Max.
0.9136
Std. dev
0.0651
Skewness
0.1309
Kurtosis
-1.314
diameter
integer
6
0
3 – 8mean 5.4
Min.
3
1st Qu.
4
Median
5
Mean
5.4
3rd Qu.
6.25
Max.
8
Std. dev
1.6026
Skewness
0.2449
Kurtosis
-1.208
GCUT_PEOE_0
numeric
20
0
-0.8628 – -0.8056mean -0.8207
Min.
-0.8628
1st Qu.
-0.8273
Median
-0.8119
Mean
-0.8207
3rd Qu.
-0.8108
Max.
-0.8056
Std. dev
0.0162
Skewness
-1.147
Kurtosis
0.0226
Outliers
11 low · 0 high
GCUT_PEOE_1
numeric
20
0
-0.4924 – -0.3312mean -0.41
Min.
-0.4924
1st Qu.
-0.443
Median
-0.4069
Mean
-0.41
3rd Qu.
-0.3867
Max.
-0.3312
Std. dev
0.0465
Skewness
0.0919
Kurtosis
-1.06
GCUT_PEOE_2
numeric
20
0
0.0161 – 0.1555mean 0.083
Min.
0.0161
1st Qu.
0.0469
Median
0.0859
Mean
0.083
3rd Qu.
0.1049
Max.
0.1555
Std. dev
0.0412
Skewness
0.0942
Kurtosis
-1.128
GCUT_PEOE_3
numeric
20
0
1.6371 – 2.3861mean 2.124
Min.
1.6371
1st Qu.
2.0384
Median
2.1632
Mean
2.1236
3rd Qu.
2.2573
Max.
2.3861
Std. dev
0.1811
Skewness
-0.955
Kurtosis
0.3517
Outliers
11 low · 0 high
GCUT_SLOGP_0
numeric
20
0
-1.3841 – -1.1574mean -1.355
Min.
-1.3841
1st Qu.
-1.3636
Median
-1.3635
Mean
-1.3552
3rd Qu.
-1.3635
Max.
-1.1574
Std. dev
0.0468
Skewness
3.743
Kurtosis
12.91
Outliers
64 low · 2 high
GCUT_SLOGP_1
numeric
20
0
-0.4976 – -0.2509mean -0.3916
Min.
-0.4976
1st Qu.
-0.4434
Median
-0.4044
Mean
-0.3916
3rd Qu.
-0.3556
Max.
-0.2509
Std. dev
0.0682
Skewness
0.4446
Kurtosis
-0.9016
GCUT_SLOGP_2
numeric
12
0
0.0441 – 0.1668mean 0.0913
Min.
0.0441
1st Qu.
0.0542
Median
0.0542
Mean
0.0913
3rd Qu.
0.1456
Max.
0.1668
Std. dev
0.049
Skewness
0.5128
Kurtosis
-1.645
GCUT_SLOGP_3
numeric
20
0
1.4484 – 2.4654mean 2.068
Min.
1.4484
1st Qu.
1.8848
Median
2.1151
Mean
2.068
3rd Qu.
2.2773
Max.
2.4654
Std. dev
0.2525
Skewness
-0.6487
Kurtosis
-0.3378
GCUT_SMR_0
numeric
20
0
-0.5321 – -0.4816mean -0.5092
Min.
-0.5321
1st Qu.
-0.5222
Median
-0.5081
Mean
-0.5092
3rd Qu.
-0.4988
Max.
-0.4816
Std. dev
0.015
Skewness
0.0253
Kurtosis
-1.278
GCUT_SMR_1
numeric
20
0
-0.252 – -0.1631mean -0.22
Min.
-0.252
1st Qu.
-0.2369
Median
-0.2297
Mean
-0.22
3rd Qu.
-0.2036
Max.
-0.1631
Std. dev
0.0245
Skewness
0.8659
Kurtosis
-0.4666
GCUT_SMR_2
numeric
20
0
0.1138 – 0.242mean 0.1902
Min.
0.1138
1st Qu.
0.178
Median
0.201
Mean
0.1902
3rd Qu.
0.2136
Max.
0.242
Std. dev
0.0379
Skewness
-0.685
Kurtosis
-0.6142
Outliers
22 low · 0 high
GCUT_SMR_3
numeric
20
0
1.8489 – 2.6798mean 2.35
Min.
1.8489
1st Qu.
2.25
Median
2.3906
Mean
2.3503
3rd Qu.
2.4919
Max.
2.6798
Std. dev
0.1922
Skewness
-0.7766
Kurtosis
0.2266
Outliers
11 low · 0 high
Kier1
numeric
12
0
5 – 12mean 8.793
Min.
5
1st Qu.
7.75
Median
9
Mean
8.793
3rd Qu.
10
Max.
12
Std. dev
1.8649
Skewness
-0.2775
Kurtosis
-0.79
Kier2
numeric
14
0
2.2222 – 6.5089mean 4.029
Min.
2.2222
1st Qu.
3.0986
Median
3.92
Mean
4.029
3rd Qu.
4.8517
Max.
6.5089
Std. dev
1.1622
Skewness
0.1809
Kurtosis
-0.8376
Kier3
numeric
13
0
1.4876 – 7.438mean 3.85
Min.
1.4876
1st Qu.
2.8125
Median
3.6097
Mean
3.8496
3rd Qu.
4.5
Max.
7.438
Std. dev
1.4149
Skewness
0.6739
Kurtosis
-0.094
Outliers
10 low · 1 high
KierA1
numeric
18
0
4.0214 – 9.6657mean 7.347
Min.
4.0214
1st Qu.
6.6989
Median
7.5752
Mean
7.347
3rd Qu.
8.1965
Max.
9.6657
Std. dev
1.4293
Skewness
-0.542
Kurtosis
-0.3389
Outliers
11 low · 0 high
KierA2
numeric
18
0
1.6858 – 5.248mean 3.298
Min.
1.6858
1st Qu.
2.6874
Median
3.4141
Mean
3.2978
3rd Qu.
3.5961
Max.
5.248
Std. dev
0.981
Skewness
0.4249
Kurtosis
-0.457
Outliers
20 low · 2 high
KierA3
numeric
19
0
1.262 – 5.4677mean 3.079
Min.
1.262
1st Qu.
2.367
Median
2.6775
Mean
3.0786
3rd Qu.
3.9368
Max.
5.4677
Std. dev
1.1573
Skewness
0.5532
Kurtosis
-0.8681
KierFlex
numeric
18
0
1.3559 – 5.6362mean 2.695
Min.
1.3559
1st Qu.
2.0387
Median
2.3877
Mean
2.6946
3rd Qu.
3.0998
Max.
5.6362
Std. dev
1.097
Skewness
1.059
Kurtosis
0.5216
Outliers
10 low · 1 high
lip_acc
integer
4
0
3 – 6mean 3.9
Min.
3
1st Qu.
3
Median
4
Mean
3.9
3rd Qu.
5
Max.
6
Std. dev
0.9679
Skewness
0.5161
Kurtosis
-1.139
lip_don
integer
5
0
2 – 7mean 3.8
Min.
2
1st Qu.
3
Median
4
Mean
3.8
3rd Qu.
4
Max.
7
Std. dev
1.105
Skewness
1.041
Kurtosis
1.187
Outliers
10 low · 1 high
logP.o.w.
numeric
19
0
-4.5397 – 0.057mean -2.782
Min.
-4.5397
1st Qu.
-3.6745
Median
-3.0232
Mean
-2.7819
3rd Qu.
-1.784
Max.
0.057
Std. dev
1.2011
Skewness
0.5632
Kurtosis
-0.6476
logS
numeric
20
0
-1.397 – 0.9248mean 0.0173
Min.
-1.397
1st Qu.
-0.4845
Median
0.115
Mean
0.0173
3rd Qu.
0.5707
Max.
0.9248
Std. dev
0.6753
Skewness
-0.5173
Kurtosis
-0.9734
mr
numeric
20
0
1.6971 – 5.7347mean 3.427
Min.
1.6971
1st Qu.
2.8664
Median
3.3804
Mean
3.4267
3rd Qu.
3.8693
Max.
5.7347
Std. dev
0.9713
Skewness
0.4509
Kurtosis
-0.2307
Outliers
10 low · 1 high
opr_brigid
integer
5
0
0 – 10mean 1.65
Min.
0
1st Qu.
0
Median
0
Mean
1.65
3rd Qu.
2
Max.
10
Std. dev
2.9784
Skewness
1.436
Kurtosis
0.7697
Zeros
14
Outliers
30 low · 3 high
opr_nrot
integer
5
0
1 – 5mean 2.9
Min.
1
1st Qu.
2
Median
3
Mean
2.9
3rd Qu.
3.25
Max.
5
Std. dev
1.1192
Skewness
0.184
Kurtosis
-0.6855
PC.
numeric
13
0
2.12 – 4.606mean 2.96
Min.
2.12
1st Qu.
2.21
Median
2.997
Mean
2.9604
3rd Qu.
3.4335
Max.
4.606
Std. dev
0.6593
Skewness
0.462
Kurtosis
-0.3625
PC..1
numeric
13
0
-4.606 – -2.12mean -2.96
Min.
-4.606
1st Qu.
-3.4337
Median
-2.997
Mean
-2.9604
3rd Qu.
-2.21
Max.
-2.12
Std. dev
0.6593
Skewness
-0.4618
Kurtosis
-0.3631
PEOE_PC.
numeric
20
0
0.9159 – 1.9639mean 1.312
Min.
0.9159
1st Qu.
1.1039
Median
1.3208
Mean
1.3116
3rd Qu.
1.5063
Max.
1.9639
Std. dev
0.2708
Skewness
0.3761
Kurtosis
-0.5494
PEOE_PC..1
numeric
20
0
-1.9639 – -0.9159mean -1.312
Min.
-1.9639
1st Qu.
-1.5063
Median
-1.3208
Mean
-1.3116
3rd Qu.
-1.1039
Max.
-0.9159
Std. dev
0.2708
Skewness
-0.3761
Kurtosis
-0.5494
PEOE_RPC.
numeric
20
0
0.1408 – 0.2985mean 0.2196
Min.
0.1408
1st Qu.
0.1838
Median
0.2112
Mean
0.2196
3rd Qu.
0.2509
Max.
0.2985
Std. dev
0.0447
Skewness
0.2395
Kurtosis
-1.21
PEOE_RPC..1
numeric
20
0
0.1885 – 0.3606mean 0.2729
Min.
0.1885
1st Qu.
0.2369
Median
0.2765
Mean
0.2729
3rd Qu.
0.3019
Max.
0.3606
Std. dev
0.0481
Skewness
0.1533
Kurtosis
-1.19
PEOE_VSA.0
numeric
12
0
0 – 40.6776mean 21.59
Min.
0
1st Qu.
8.5308
Median
25.6776
Mean
21.5887
3rd Qu.
31.2212
Max.
40.6776
Std. dev
13.1425
Skewness
-0.1763
Kurtosis
-1.457
Zeros
2
PEOE_VSA.1
numeric
11
0
4.2654 – 32.9314mean 15.11
Min.
4.2654
1st Qu.
7.4113
Median
10.189
Mean
15.1108
3rd Qu.
23.2292
Max.
32.9314
Std. dev
9.9197
Skewness
0.6799
Kurtosis
-1.228
PEOE_VSA.2
numeric
6
0
8.619 – 34.4761mean 18.9
Min.
8.619
1st Qu.
17.238
Median
17.238
Mean
18.9005
3rd Qu.
20.384
Max.
34.4761
Std. dev
5.0443
Skewness
1.346
Kurtosis
2.99
Outliers
31 low · 2 high
PEOE_VSA.3
numeric
4
0
0 – 50.1576mean 5.094
Min.
0
1st Qu.
0
Median
0
Mean
5.0936
3rd Qu.
2.1548
Max.
50.1576
Std. dev
12.0083
Skewness
2.691
Kurtosis
7.046
Zeros
15
Outliers
50 low · 5 high
PEOE_VSA.0.1
numeric
9
0
0 – 40.1024mean 12.59
Min.
0
1st Qu.
0
Median
8.7013
Mean
12.5894
3rd Qu.
19.8519
Max.
40.1024
Std. dev
13.4821
Skewness
0.6125
Kurtosis
-1.074
Zeros
8
PEOE_VSA.1.1
numeric
7
0
0 – 61.2745mean 12.62
Min.
0
1st Qu.
0
Median
0
Mean
12.6219
3rd Qu.
27.5735
Max.
61.2745
Std. dev
19.924
Skewness
1.096
Kurtosis
-0.3572
Zeros
13
PEOE_VSA.6.1
numeric
6
0
7.9044 – 27.7209mean 17.71
Min.
7.9044
1st Qu.
14.4187
Median
14.5556
Mean
17.7113
3rd Qu.
22.1862
Max.
27.7209
Std. dev
4.7957
Skewness
0.1237
Kurtosis
-0.8435
PEOE_VSA_FHYD
numeric
19
0
0.2965 – 0.7367mean 0.5622
Min.
0.2965
1st Qu.
0.4582
Median
0.6168
Mean
0.5622
3rd Qu.
0.6625
Max.
0.7367
Std. dev
0.1292
Skewness
-0.5096
Kurtosis
-1.196
PEOE_VSA_FNEG
numeric
19
0
0.208 – 0.5574mean 0.4009
Min.
0.208
1st Qu.
0.3448
Median
0.4187
Mean
0.4009
3rd Qu.
0.4529
Max.
0.5574
Std. dev
0.0854
Skewness
-0.2321
Kurtosis
-0.5124
PEOE_VSA_FPNEG
numeric
19
0
0.1393 – 0.3491mean 0.2316
Min.
0.1393
1st Qu.
0.1788
Median
0.2108
Mean
0.2316
3rd Qu.
0.2974
Max.
0.3491
Std. dev
0.0646
Skewness
0.3583
Kurtosis
-1.385
PEOE_VSA_FPOL
numeric
19
0
0.2633 – 0.7035mean 0.4378
Min.
0.2633
1st Qu.
0.3375
Median
0.3832
Mean
0.4378
3rd Qu.
0.5418
Max.
0.7035
Std. dev
0.1292
Skewness
0.5096
Kurtosis
-1.196
PEOE_VSA_FPOS
numeric
19
0
0.4426 – 0.792mean 0.5991
Min.
0.4426
1st Qu.
0.5471
Median
0.5813
Mean
0.5991
3rd Qu.
0.6552
Max.
0.792
Std. dev
0.0854
Skewness
0.2321
Kurtosis
-0.5124
PEOE_VSA_FPPOS
numeric
19
0
0.1233 – 0.3544mean 0.2062
Min.
0.1233
1st Qu.
0.1529
Median
0.1887
Mean
0.2062
3rd Qu.
0.2597
Max.
0.3544
Std. dev
0.0684
Skewness
0.564
Kurtosis
-0.9581
PEOE_VSA_HYD
numeric
19
0
38.9611 – 148.71mean 88.21
Min.
38.9611
1st Qu.
59.118
Median
85.002
Mean
88.2111
3rd Qu.
114.604
Max.
148.71
Std. dev
32.7453
Skewness
0.0867
Kurtosis
-1.383
PEOE_VSA_NEG
numeric
19
0
27.9856 – 100.17mean 62.08
Min.
27.9856
1st Qu.
49.0409
Median
57.4631
Mean
62.0774
3rd Qu.
74.1823
Max.
100.17
Std. dev
20.3592
Skewness
0.2501
Kurtosis
-0.9783
PEOE_VSA_PNEG
numeric
9
0
21.4714 – 49.32mean 34.56
Min.
21.4714
1st Qu.
27.9856
Median
30.9638
Mean
34.5599
3rd Qu.
38.5574
Max.
49.32
Std. dev
8.9602
Skewness
0.6009
Kurtosis
-1.185
PEOE_VSA_POL
numeric
9
0
46.504 – 99.3854mean 64.94
Min.
46.504
1st Qu.
53.0183
Median
55.9964
Mean
64.9394
3rd Qu.
71.3332
Max.
99.3854
Std. dev
16.4167
Skewness
0.9058
Kurtosis
-0.571
Outliers
20 low · 2 high
PEOE_VSA_POS
numeric
17
0
62.4782 – 138.624mean 91.07
Min.
62.4782
1st Qu.
79.5397
Median
88.0705
Mean
91.0731
3rd Qu.
100.619
Max.
138.624
Std. dev
19.9412
Skewness
0.7016
Kurtosis
-0.1141
Outliers
10 low · 1 high
PEOE_VSA_PPOS
numeric
4
0
25.0327 – 50.0653mean 30.38
Min.
25.0327
1st Qu.
25.0327
Median
25.0327
Mean
30.3795
3rd Qu.
35.3568
Max.
50.0653
Std. dev
8.3875
Skewness
1.23
Kurtosis
0.228
petitjean
numeric
4
0
0.3333 – 0.5mean 0.4562
Min.
0.3333
1st Qu.
0.4
Median
0.5
Mean
0.4562
3rd Qu.
0.5
Max.
0.5
Std. dev
0.0595
Skewness
-0.8173
Kurtosis
-0.8492
petitjeanSC
numeric
4
0
0.5 – 1mean 0.8583
Min.
0.5
1st Qu.
0.6667
Median
1
Mean
0.8583
3rd Qu.
1
Max.
1
Std. dev
0.1875
Skewness
-0.672
Kurtosis
-1.241
Q_PC.
numeric
13
0
2.12 – 4.606mean 2.96
Min.
2.12
1st Qu.
2.21
Median
2.997
Mean
2.9604
3rd Qu.
3.4335
Max.
4.606
Std. dev
0.6593
Skewness
0.462
Kurtosis
-0.3625
Q_PC..1
numeric
13
0
-4.606 – -2.12mean -2.96
Min.
-4.606
1st Qu.
-3.4337
Median
-2.997
Mean
-2.9604
3rd Qu.
-2.21
Max.
-2.12
Std. dev
0.6593
Skewness
-0.4618
Kurtosis
-0.3631
Q_RPC.
numeric
13
0
0.1431 – 0.3108mean 0.2331
Min.
0.1431
1st Qu.
0.1919
Median
0.2202
Mean
0.2331
3rd Qu.
0.2982
Max.
0.3108
Std. dev
0.051
Skewness
0.2095
Kurtosis
-1.393
Q_RPC..1
numeric
13
0
0.2149 – 0.448mean 0.3481
Min.
0.2149
1st Qu.
0.2883
Median
0.3308
Mean
0.3481
3rd Qu.
0.4304
Max.
0.448
Std. dev
0.0737
Skewness
0.1695
Kurtosis
-1.376
Q_VSA_FHYD
numeric
19
0
0.0927 – 0.5916mean 0.3323
Min.
0.0927
1st Qu.
0.2139
Median
0.3108
Mean
0.3323
3rd Qu.
0.4981
Max.
0.5916
Std. dev
0.1629
Skewness
0.1051
Kurtosis
-1.507
Q_VSA_FNEG
numeric
19
0
0.1725 – 0.509mean 0.2992
Min.
0.1725
1st Qu.
0.223
Median
0.2909
Mean
0.2992
3rd Qu.
0.3361
Max.
0.509
Std. dev
0.1048
Skewness
0.6795
Kurtosis
-0.6487
Outliers
20 low · 2 high
Q_VSA_FPNEG
numeric
19
0
0.1557 – 0.4148mean 0.2537
Min.
0.1557
1st Qu.
0.1918
Median
0.2523
Mean
0.2537
3rd Qu.
0.3009
Max.
0.4148
Std. dev
0.0699
Skewness
0.432
Kurtosis
-0.7541
Q_VSA_FPOL
numeric
19
0
0.4084 – 0.9073mean 0.6677
Min.
0.4084
1st Qu.
0.5019
Median
0.6892
Mean
0.6677
3rd Qu.
0.7861
Max.
0.9073
Std. dev
0.1629
Skewness
-0.1051
Kurtosis
-1.507
Q_VSA_FPOS
numeric
19
0
0.491 – 0.8275mean 0.7008
Min.
0.491
1st Qu.
0.6639
Median
0.7091
Mean
0.7008
3rd Qu.
0.777
Max.
0.8275
Std. dev
0.1048
Skewness
-0.6795
Kurtosis
-0.6487
Outliers
22 low · 0 high
Q_VSA_FPPOS
numeric
19
0
0.2527 – 0.603mean 0.4141
Min.
0.2527
1st Qu.
0.3083
Median
0.4308
Mean
0.4141
3rd Qu.
0.4735
Max.
0.603
Std. dev
0.1083
Skewness
0.0341
Kurtosis
-1.237
Q_VSA_HYD
numeric
16
0
8.5308 – 106.308mean 53.26
Min.
8.5308
1st Qu.
32.2313
Median
45.0424
Mean
53.2599
3rd Qu.
75.9265
Max.
106.308
Std. dev
31.0731
Skewness
0.3252
Kurtosis
-1.302
Q_VSA_NEG
numeric
13
0
21.4714 – 102.659mean 46.66
Min.
21.4714
1st Qu.
27.9856
Median
43.669
Mean
46.6566
3rd Qu.
49.32
Max.
102.659
Std. dev
22.5354
Skewness
1.217
Kurtosis
0.4077
Outliers
30 low · 3 high
Q_VSA_PNEG
numeric
11
0
21.4714 – 54.3486mean 38.02
Min.
21.4714
1st Qu.
27.9856
Median
35.7531
Mean
38.0246
3rd Qu.
47.8606
Max.
54.3486
Std. dev
9.8929
Skewness
0.0315
Kurtosis
-1.545
Q_VSA_POL
numeric
14
0
71.4613 – 155.737mean 99.89
Min.
71.4613
1st Qu.
73.4022
Median
97.583
Mean
99.8906
3rd Qu.
119.769
Max.
155.737
Std. dev
23.6524
Skewness
0.4299
Kurtosis
-0.7178
Q_VSA_POS
numeric
19
0
63.9938 – 156.027mean 106.5
Min.
63.9938
1st Qu.
91.0204
Median
101.739
Mean
106.494
3rd Qu.
120.278
Max.
156.027
Std. dev
23.4216
Skewness
0.2644
Kurtosis
-0.7495
Q_VSA_PPOS
numeric
13
0
45.4167 – 108.767mean 61.87
Min.
45.4167
1st Qu.
48.8466
Median
55.9174
Mean
61.8659
3rd Qu.
71.9201
Max.
108.767
Std. dev
16.143
Skewness
1.079
Kurtosis
0.9851
Outliers
10 low · 1 high
radius
integer
3
0
2 – 4mean 2.9
Min.
2
1st Qu.
2
Median
3
Mean
2.9
3rd Qu.
3.25
Max.
4
Std. dev
0.7881
Skewness
0.1594
Kurtosis
-1.456
RPC.
numeric
13
0
0.1431 – 0.3108mean 0.2331
Min.
0.1431
1st Qu.
0.1919
Median
0.2202
Mean
0.2331
3rd Qu.
0.2982
Max.
0.3108
Std. dev
0.051
Skewness
0.2095
Kurtosis
-1.393
RPC..1
numeric
13
0
0.2149 – 0.448mean 0.3481
Min.
0.2149
1st Qu.
0.2883
Median
0.3308
Mean
0.3481
3rd Qu.
0.4304
Max.
0.448
Std. dev
0.0737
Skewness
0.1695
Kurtosis
-1.376
SlogP
numeric
19
0
-1.7263 – 1.1223mean -0.4805
Min.
-1.7263
1st Qu.
-1.1505
Median
-0.6089
Mean
-0.4805
3rd Qu.
0.2002
Max.
1.1223
Std. dev
0.8284
Skewness
0.1822
Kurtosis
-1.22
SlogP_VSA0
numeric
5
0
18.0108 – 98.6916mean 44.18
Min.
18.0108
1st Qu.
32.8972
Median
32.8972
Mean
44.1849
3rd Qu.
58.2824
Max.
98.6916
Std. dev
19.4424
Skewness
1.125
Kurtosis
0.5914
Outliers
10 low · 1 high
SlogP_VSA1
numeric
5
0
7.7455 – 24.531mean 9.98
Min.
7.7455
1st Qu.
7.7455
Median
7.7455
Mean
9.9801
3rd Qu.
10.4845
Max.
24.531
Std. dev
4.3576
Skewness
2.003
Kurtosis
3.544
Outliers
30 low · 3 high
SlogP_VSA2
numeric
5
0
23.8622 – 51.7064mean 34.42
Min.
23.8622
1st Qu.
27.8442
Median
27.8442
Mean
34.4195
3rd Qu.
44.6297
Max.
51.7064
Std. dev
10.347
Skewness
0.8217
Kurtosis
-1.195
SlogP_VSA3
numeric
5
0
25.3852 – 50.7705mean 34.38
Min.
25.3852
1st Qu.
25.3852
Median
25.3852
Mean
34.3813
3rd Qu.
43.8248
Max.
50.7705
Std. dev
10.4181
Skewness
0.3087
Kurtosis
-1.822
SlogP_VSA4
numeric
4
0
0 – 4.4108mean 1.277
Min.
0
1st Qu.
0
Median
0
Mean
1.2773
3rd Qu.
3.1856
Max.
4.4108
Std. dev
1.8322
Skewness
0.726
Kurtosis
-1.365
Zeros
13
SlogP_VSA5
numeric
4
0
0 – 31.6912mean 6.197
Min.
0
1st Qu.
0
Median
0
Mean
6.1975
3rd Qu.
17.3062
Max.
31.6912
Std. dev
10.1098
Skewness
1.092
Kurtosis
-0.3258
Zeros
14
SlogP_VSA7
numeric
5
0
0 – 92.5042mean 14.26
Min.
0
1st Qu.
0
Median
0
Mean
14.2646
3rd Qu.
0
Max.
92.5042
Std. dev
31.1245
Skewness
1.697
Kurtosis
1.169
Zeros
16
SlogP_VSA8
numeric
5
0
0 – 56.6052mean 17.4
Min.
0
1st Qu.
0
Median
18.8684
Mean
17.4001
3rd Qu.
37.7368
Max.
56.6052
Std. dev
18.85
Skewness
0.5238
Kurtosis
-1.198
Zeros
9
SlogP_VSA9
numeric
5
0
0 – 66.652mean 15.2
Min.
0
1st Qu.
0
Median
0
Mean
15.2036
3rd Qu.
32.4962
Max.
66.652
Std. dev
25.1222
Skewness
1.194
Kurtosis
-0.2355
Zeros
13
SMR
numeric
19
0
1.669 – 5.7614mean 3.409
Min.
1.669
1st Qu.
2.8461
Median
3.326
Mean
3.4091
3rd Qu.
3.854
Max.
5.7614
Std. dev
0.9799
Skewness
0.4721
Kurtosis
-0.205
Outliers
10 low · 1 high
SMR_VSA2
numeric
5
0
25.3852 – 50.7705mean 31.16
Min.
25.3852
1st Qu.
25.3852
Median
25.3852
Mean
31.1645
3rd Qu.
32.8897
Max.
50.7705
Std. dev
9.0818
Skewness
1.151
Kurtosis
-0.3492
Outliers
20 low · 2 high
SMR_VSA3
numeric
6
0
0 – 12.411mean 4.984
Min.
0
1st Qu.
3.982
Median
3.982
Mean
4.9841
3rd Qu.
4.6712
Max.
12.411
Std. dev
2.6809
Skewness
1.197
Kurtosis
1.473
Zeros
1
Outliers
61 low · 5 high
SMR_VSA4
numeric
5
0
0 – 98.6916mean 39.71
Min.
0
1st Qu.
32.8972
Median
32.8972
Mean
39.7125
3rd Qu.
34.0765
Max.
98.6916
Std. dev
20.1978
Skewness
1.161
Kurtosis
1.809
Zeros
1
Outliers
61 low · 5 high
SMR_VSA5
numeric
8
0
0 – 107.084mean 32.9
Min.
0
1st Qu.
0
Median
18.8684
Mean
32.8972
3rd Qu.
41.5197
Max.
107.084
Std. dev
34.5446
Skewness
0.9518
Kurtosis
-0.268
Zeros
6
Outliers
20 low · 2 high
SMR_VSA6
numeric
7
0
7.7455 – 28.6717mean 15.6
Min.
7.7455
1st Qu.
7.7455
Median
13.0042
Mean
15.5984
3rd Qu.
25.2805
Max.
28.6717
Std. dev
8.607
Skewness
0.3919
Kurtosis
-1.715
SMR_VSA7
numeric
5
0
0 – 66.652mean 18.83
Min.
0
1st Qu.
0
Median
0
Mean
18.8313
3rd Qu.
36.5213
Max.
66.652
Std. dev
27.7838
Skewness
0.8375
Kurtosis
-1.146
Zeros
13
TPSA
numeric
10
0
49.33 – 127.72mean 82.38
Min.
49.33
1st Qu.
63.32
Median
83.55
Mean
82.3785
3rd Qu.
100.62
Max.
127.72
Std. dev
20.5922
Skewness
0.329
Kurtosis
-0.9438
VAdjEq
numeric
12
0
0.59 – 0.9044mean 0.7238
Min.
0.59
1st Qu.
0.6801
Median
0.717
Mean
0.7238
3rd Qu.
0.7692
Max.
0.9044
Std. dev
0.0811
Skewness
0.4031
Kurtosis
-0.582
Outliers
10 low · 1 high
VAdjMa
numeric
10
0
3 – 5mean 4.041
Min.
3
1st Qu.
3.8074
Median
4
Mean
4.041
3rd Qu.
4.2423
Max.
5
Std. dev
0.4694
Skewness
-0.1128
Kurtosis
-0.1999
Outliers
21 low · 1 high
VDistEq
numeric
15
0
1.5219 – 2.9098mean 2.27
Min.
1.5219
1st Qu.
1.9389
Median
2.2608
Mean
2.2699
3rd Qu.
2.5448
Max.
2.9098
Std. dev
0.4075
Skewness
-0.2064
Kurtosis
-1.156
VDistMa
numeric
15
0
4.1972 – 7.5043mean 6.005
Min.
4.1972
1st Qu.
5.6648
Median
5.9967
Mean
6.0047
3rd Qu.
6.3627
Max.
7.5043
Std. dev
0.7779
Skewness
-0.2952
Kurtosis
-0.1491
Outliers
21 low · 1 high
vdw_area
numeric
19
0
91.9794 – 202.997mean 153.2
Min.
91.9794
1st Qu.
135.11
Median
160.376
Mean
153.15
3rd Qu.
169.285
Max.
202.997
Std. dev
29.9089
Skewness
-0.1643
Kurtosis
-0.8009
vdw_vol
numeric
19
0
87.1268 – 271.878mean 172.4
Min.
87.1268
1st Qu.
145.392
Median
173.19
Mean
172.424
3rd Qu.
192.967
Max.
271.878
Std. dev
45.1942
Skewness
0.2362
Kurtosis
-0.5112
Outliers
10 low · 1 high
vsa_don
numeric
4
0
0 – 35.485mean 3.833
Min.
0
1st Qu.
0
Median
0
Mean
3.8326
3rd Qu.
0
Max.
35.485
Std. dev
9.2545
Skewness
2.284
Kurtosis
4.376
Zeros
16
vsa_hyd
numeric
16
0
20.2995 – 117.158mean 58.03
Min.
20.2995
1st Qu.
34.2705
Median
54.0616
Mean
58.0293
3rd Qu.
83.5335
Max.
117.158
Std. dev
30.159
Skewness
0.3638
Kurtosis
-1.264
vsa_other
numeric
6
0
14.7085 – 46.093mean 21.07
Min.
14.7085
1st Qu.
14.7085
Median
14.7085
Mean
21.0671
3rd Qu.
28.0978
Max.
46.093
Std. dev
9.7465
Skewness
1.142
Kurtosis
0.0473
vsa_pol
numeric
9
0
32.8164 – 86.0439mean 55.95
Min.
32.8164
1st Qu.
44.8763
Median
53.4002
Mean
55.9506
3rd Qu.
64.9667
Max.
86.0439
Std. dev
14.2329
Skewness
0.5037
Kurtosis
-0.9309
Weight
numeric
19
0
75.067 – 204.229mean 136.9
Min.
75.067
1st Qu.
118.627
Median
132.611
Mean
136.902
3rd Qu.
150.7
Max.
204.229
Std. dev
30.8642
Skewness
0.1212
Kurtosis
-0.3255
Outliers
10 low · 1 high
weinerPath
integer
15
0
18 – 369mean 124.5
Min.
18
1st Qu.
64.25
Median
96
Mean
124.45
3rd Qu.
148.5
Max.
369
Std. dev
89.7526
Skewness
1.131
Kurtosis
0.5591
Outliers
10 low · 1 high
weinerPol
integer
10
0
2 – 20mean 8.9
Min.
2
1st Qu.
7.5
Median
8
Mean
8.9
3rd Qu.
10
Max.
20
Std. dev
3.8784
Skewness
0.9871
Kurtosis
1.404
Outliers
31 low · 2 high
zagreb
integer
13
0
16 – 76mean 38.7
Min.
16
1st Qu.
32
Median
36
Mean
38.7
3rd Qu.
42
Max.
76
Std. dev
13.6925
Skewness
0.8986
Kurtosis
0.7272
Outliers
31 low · 2 high
The same data in 2 other packages

This data is identical to the data these packages carry, down to the byte.

BioMedRCRANprotrCRAN

The structure fingerprint found nothing beyond this list.

Version history
VersionReleasedSizeChangeStored asConfidence
3.232026-04-2820 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.222025-10-2920 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.212025-04-1520 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.202024-10-2920 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.192024-09-0920 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.182023-10-2420 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.172023-06-2720 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.162022-11-0120 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.152022-07-1720 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.142021-10-2620 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.132021-05-1920 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.122020-10-2720 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.112020-04-2720 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.102019-10-2920 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.92019-05-1720 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.82019-02-2420 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.72018-07-1520 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.62017-11-1720 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.52017-09-2420 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.42016-12-3020 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.32016-05-0320 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.22015-10-1320 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.12015-04-1620 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
3.02014-10-1320 × 148Unchangedrda · gzip
version 2 · 14 KB
exact
2.142014-09-1020 × 148–rda · gzip
version 2 · 14 KB
exact

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