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Journal of Computational Chemistry
›
top-authors
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most-cited
Journal of Computational Chemistry
2.7
(top 20%)
impact factor
8.5K
(top 2%)
papers
703.7K
(top 1%)
citations
257
(top 1%)
h
-index
2.7
(top 20%)
extended IF
10.0K
all documents
745.4K
doc citations
749
(top 0.1%)
g
-index
Top Authors (by article citations)
#
Author
Articles
Citations
R ARank
R CRank
1
Alexander D Mackerell
2
2,618
4
1
1
Jing Huang
1
2,613
1
1
1
Alexander D Mackerell Jr
2
2,618
2
1
5
Russell Anderson
1
1,583
1
1
5
Alessandro Soncini
1
1,583
2
1
5
Nicholas F Chilton
1
1,583
5
1
5
Lincoln D Turner
1
1,583
2
1
5
Keith S Murray
1
1,583
4
1
10
Clark Landis
1
1,269
1
1
10
Eric D Glendening
1
1,269
1
1
10
Frank Weinhold
1
1,269
1
1
13
Volker L Deringer
2
1,194
1
1
13
Richard Dronskowski
2
1,194
3
1
13
Andrei L Tchougréeff
1
1,178
2
1
13
Stefan Maintz
1
1,178
1
1
17
Michael Florian Peintinger
1
830
1
1
17
Thomas Bredow
1
830
2
1
19
Ester Papa
1
516
2
1
19
Paola Gramatica
2
518
1
1
21
Emad Tajkhorshid
1
403
3
1
21
Christopher G Mayne
1
403
1
1
21
James C Gumbart
1
403
3
2
24
Supratik Kar
1
366
1
1
24
Kunal Roy
1
366
3
1
24
Rudra Narayan Das
1
366
1
1
24
Probir Kumar Ojha
1
366
1
1
24
Indrani Mitra
1
366
1
1
30
Sebastian Ehlert
1
358
3
2
30
Stefan Grimme
1
358
7
3
30
Rebecca Sure
1
358
1
1
33
Jan M L Martin
1
292
3
2
33
Sebastian Kozuch
1
292
2
2
35
Annia Galano
1
289
2
2
35
J Raul Alvarez-Idaboy
1
289
1
1
37
Lucas Visscher
1
212
3
1
38
Zhan-Wei Li
1
201
1
1
38
Zhong-Yuan Lu
1
201
4
2
38
Hu-Jun Qian
1
201
2
1
38
Hong Liu
1
201
1
1
38
You-Liang Zhu
1
201
1
1
43
Paul M Zimmerman
1
179
1
1
44
Yun Geng
1
130
1
1
44
Zhongmin Su
3
172
8
9
44
Yong Wu
1
130
3
1
44
Hai-Bin Li
1
130
3
1
48
Chinh Tran-To Su
1
117
2
1
48
Shuo Zhou
1
117
1
1
48
Runtao Li
1
117
1
1
48
Chee Keong Kwoh
1
117
2
1
48
Xuchang Ouyang
1
117
1
1
53
John E Stone
1
112
1
1
53
Jason L Locklin
1
112
1
2
53
Zaida Luthey-Schulten
1
112
3
1
53
Jenna A Bilbrey
1
112
1
2
53
Wesley D Allen
1
112
2
1
53
Elijah Roberts
1
112
2
2
53
Edward F C Byrd
1
112
1
1
53
Betsy M Rice
1
112
1
1
53
Arianna H Kazez
1
112
1
1
63
Zhong-Fang Chen
1
111
4
5
63
Jijun Zhao
1
111
6
6
65
Walter Thiel
1
108
9
5
65
Rong-Zhen Liao
1
108
2
1
65
Cherumuttathu H Suresh
1
108
2
1
65
Nicholas M Glykos
1
108
1
1
70
Anna I Krylov
2
152
1
5
70
Prashant Uday Manohar
1
105
1
1
70
Arik Landau
1
105
1
1
70
Dmitry Zuev
1
105
2
2
74
Alejandro Gaita-Arińo
1
91
2
1
74
Palii Andrew
1
91
1
1
74
Eugenio Coronado
1
91
8
5
74
José J Baldoví
1
91
1
1
74
Juan M Clemente-Juan
1
91
4
2
74
Salvador Cardona Serra
1
91
2
1
80
Holger Gohlke
2
136
2
3
81
James E Avery
1
82
1
1
81
Peter Schwerdtfeger
2
117
2
1
83
Juan I Rodríguez
1
79
1
1
84
Bernd Hartke
1
77
1
1
84
Adri van Duin
1
77
4
9
84
Henrik R Larsson
1
77
1
1
87
Camilo Rindt
1
74
1
1
87
Markus Hütter
1
74
1
1
87
Eldhose Iype
1
74
1
1
90
Danny E P Vanpoucke
2
100
1
1
90
Patrick Bultinck
3
114
2
2
92
Xiaohua Zhang
1
69
1
1
93
Roland H Lindh
2
102
2
2
93
Thomas B Pedersen
1
67
1
1
93
Trygve Helgaker
3
80
2
2
93
Simen Reine
2
74
1
1
93
Francesco Aquilante
1
67
2
2
93
Patrick Merlot
1
67
1
1
99
Kimihiko Hirao
2
70
1
1
99
Jong-Won Song
2
70
1
1
99
Rahul Kar
2
70
1
1
102
zhenmin Tang
1
64
3
3
102
Jun Hu
1
64
1
2
102
Hong-Bin Shen
1
64
2
3
102
Dong-Jun Yu
1
64
1
2
106
Stefan Boresch
1
63
1
1
106
Chris Oostenbrink
2
78
1
3
106
Anita de Ruiter
1
63
1
1
109
Jerome Baudry
1
62
1
1
109
Miao Song
1
62
1
2
109
Jeremy C Smith
1
62
5
4
109
Yongliang Yang
1
62
1
1
109
Sally R Ellingson
1
62
1
1
114
Alessandro Erba
1
61
3
3
114
Lorenzo Maschio
2
73
2
3
114
Roberto Dovesi
2
73
3
3
114
Matteo Ferrabone
1
61
2
1
118
Deok-Soo Kim
1
60
1
1
118
Aatto I Laaksonen
1
60
2
2
118
Chaok Seok
1
60
2
3
118
Alexander P Lyubartsev
1
60
3
4
118
Francesca Mocci
1
60
1
1
118
Woong-Hee Shin
1
60
1
1
118
Jae-Kwan Kim
1
60
1
1
126
Satoru G Itoh
3
93
1
1
126
Hisashi Okumura
3
93
1
1
128
Wolfgang Wenzel
1
57
2
4
128
Michael Gilson
1
57
1
1
128
Denis A Danilov
1
57
1
1
128
Michael K Gilson
1
57
1
1
132
Lyudmila V Slipchenko
2
101
1
3
133
Neeraj Kumar
1
53
5
5
133
Neeraj Kumar
1
53
1
1
133
Maria Jaworska
1
53
1
1
133
Bryan M Wong
1
53
1
3
133
Pawel M Kozlowski
1
53
1
1
133
Victoria A Roberts
1
53
1
1
133
Dmytro M Hovorun
1
53
4
4
133
Piotr Lodowski
1
53
1
1
133
Piotr Piecuch
1
53
2
3
133
Ol'ha O Brovarets'
1
53
2
4
133
Jesse J Lutz
1
53
1
1
144
James T Macdonald
1
52
1
1
144
Lawrence A Kelley
1
52
1
1
144
Benjamin L Moore
1
52
1
1
144
James W Murray
1
52
2
2
148
Wilfred F Van Gunsteren
3
57
1
2
148
Zhixiong Lin
3
57
1
1
150
Sven Jakobtorweihen
1
50
1
1
150
Irina V Smirnova
1
50
3
4
152
Joshua D Knowles
1
47
2
1
152
Paul l A Popelier
1
47
1
2
152
YIhan Shao
1
47
2
2
152
Shaun M Kandathil
1
47
1
1
152
Dmytro Kosenkov
1
47
1
1
152
Debashree Ghosh
1
47
1
1
158
Robert Zalesny
3
87
1
1
158
Ireneusz W Bulik
1
46
3
3
158
Aggelos Avramopoulos
2
52
1
1
158
Josep M Luis
2
52
2
4
158
Wojciech Bartkowiak
2
74
1
1
158
Sheng-You Huang
1
46
2
2
158
Xiaoqin Zou
1
46
2
2
165
Marzio Rosi
1
44
2
3
165
Noelia Faginas Lago
1
44
2
3
165
Thomas Simonson
3
93
1
1
165
Thomas Gaillard
1
44
1
1
165
Savvas Polydorides
2
74
1
1
165
Alessandro Costantini
1
44
1
1
165
Georgios Archontis
1
44
1
1
165
Andrea Lombardi
1
44
3
3
165
Leonardo Pacifici
1
44
1
1
174
Ida-Marie Høyvik
2
53
1
1
174
Branislav Jansik
2
53
1
1
177
Lili Duan
1
42
1
1
177
Ye Mei
2
58
2
1
177
Yifei Qi
2
47
2
2
177
John Zh Zhang
2
47
1
1
181
Kwang S Kim
1
41
7
13
181
Diego Frezzato
1
41
2
1
181
Paolo Nicolini
1
41
2
1
181
Riccardo Chelli
1
41
1
1
185
Peter A Limacher
1
40
1
3
185
Benoît Ît Champagne
1
40
4
5
185
Ahmed A K Mohammed
1
40
1
1
188
Mitsutaka Okumura
1
39
5
6
188
Toru Matsui
1
39
1
1
188
Yasuteru Shigeta
2
40
2
4
188
Binju Wang
1
39
1
3
188
Yasutaka Kitagawa
1
39
2
2
188
Zexing Cao
1
39
4
4
194
Brajesh K Rai
1
38
1
1
194
Lin-Wang Wang
1
38
2
7
194
João T S Coimbra
1
38
1
2
194
António Jm Ribeiro
1
38
1
3
194
Linbo Zhang
1
38
1
1
194
Robert Eisenberg
1
38
3
3
194
Sergio F Sousa
2
57
1
3
194
Maria J. Ramos
2
71
1
3
194
Linbo Zhang
1
38
1
1
194
Pedro Alexandrino Fernandes
1
38
5
7
194
Benzhuo Lu
1
38
2
1
194
Pedro A Fernandes
1
38
2
4
207
Li Rao
1
37
1
1
207
Xin Xu
2
63
1
1
207
Matthew A Addicoat
1
37
1
5
207
Alister J Page
1
37
3
3
207
Igor Ying Zhang
2
63
1
2
207
Eric Meggers
1
37
1
8
207
Hui Li
1
37
2
1
207
Rui Lai
1
37
1
1
207
Stephan Irle
1
37
7
9
207
Wenping Guo
1
37
1
1
217
Hyungjun Kim
1
36
1
1
217
Hyungjun Kim
1
36
1
1
219
Kristoffer Enøe Johansson
1
35
1
1
219
Lubomir Antonov
1
35
1
1
219
Jes Frellsen
1
35
1
2
219
Mickaël G Delcey
1
35
1
1
219
Valera Veryazov
2
39
1
2
219
Mikael Borg
1
35
1
1
219
Jan H Jensen
1
35
3
5
219
Fu Kit Sheong
1
35
1
2
219
Simon Olsson
1
35
1
2
219
Kresten Lindorff-Larsen
1
35
1
4
219
Hironori Kokubo
1
35
1
1
219
Yuko Okamoto
1
35
3
3
219
Xuhui Huang
1
35
2
4
219
Jan Brink Valentin
1
35
1
1
219
Wouter Boomsma
1
35
2
2
219
Per-Åke Malmqvist
1
35
1
1
219
Pengfei Tian
1
35
1
1
219
Sandro Bottaro
1
35
1
2
219
Thomas Hamelryck
1
35
2
2
219
Jesper Ferkinghoff-Borg
1
35
1
1
219
Tim Harder
1
35
1
1
219
Jian Sun
1
35
1
3
219
Steven Vancoillie
1
35
1
1
219
Christian Andreetta
1
35
1
1
219
Kasper Stovgaard
1
35
1
1
244
Jay W Ponder
1
34
1
3
244
Jin Yu Xiang
1
34
1
1
246
Takao Tsuneda
1
33
1
1
246
Raman Kumar Singh
1
33
1
1
246
Alexandra T P Carvalho
1
33
1
1
249
Yong-Qing Li
1
32
1
1
249
dimas Suarez
1
32
1
1
249
Ernesto Suárez
1
32
1
1
249
Charles L Brooks
1
32
3
7
249
Mengtao Sun
1
32
5
8
249
Natalia Diaz
1
32
1
1
249
Joseph D Yesselman
1
32
1
2
249
Charles L Brooks Iii
1
32
1
1
257
Petr Štěpánek
1
31
1
1
257
Petr Bouř
3
75
1
1
257
Petr Stepanek
1
31
1
5
257
Robert J Hinde
1
31
1
1
257
Jason B Harris
1
31
2
4
262
Assoc Prof Bo Durbeej
1
30
1
1
262
Jacek Koput
1
30
2
1
264
Valérie Vallet
1
29
1
2
264
W Gero Schmidt
1
29
4
4
264
Evert Jan Baerends
1
29
2
4
264
Sonja Herres-Pawlis
1
29
3
3
264
Florent Réal
1
29
2
2
264
Michael Trumm
1
29
1
1
264
Prasad Bharatam
1
29
3
4
264
Sonam Bhatia
1
29
1
1
264
Michel Masella
2
46
1
1
264
Andranik Kazaryan
1
29
1
1
274
Angelika Baranowska-Łączkowska
3
63
1
1
274
Li Yang
1
28
1
1
274
Likai Du
1
28
1
1
274
Filip Pawłowski
1
28
1
2
274
Jun Gao
1
28
1
1
274
Francisco Torrens
1
28
3
3
274
Robert W Góra
1
28
4
3
274
Yovani Marrero-Ponce
1
28
2
2
274
Michel Caffarel
1
28
1
2
274
Stephen J Barigye
1
28
1
1
274
Anthony Scemama
1
28
1
1
285
Masahiro Ehara
2
28
2
4
285
Carlo Adamo
1
27
8
10
285
Ilaria Ciofini
1
27
6
6
285
David Casanova
2
34
1
2
285
Chris -Kriton Skylaris
2
45
1
2
285
Daniel J Cole
1
27
1
4
285
Ryoichi Fukuda
1
27
3
3
292
Emil Alexov
1
26
3
9
292
Lin Li
1
26
1
2
292
Neil Qiang Su
1
26
1
2
292
Marharyta Petukh
1
26
1
3
292
Pulak Naskar
1
26
2
2
292
Pinaki Chaudhury
1
26
2
2
292
Glake A Hill
1
26
2
1
292
David H Magers
1
26
1
1
292
Ramon Carbó-Dorca i Carré
1
26
2
2
292
Themis Lazaridis
2
44
1
2
292
Olga Yuzlenko
1
26
1
1
292
Soumya Ganguly Neogi
1
26
1
1
304
Yi Ren
1
25
1
2
304
Bing Xiong
1
25
3
3
304
Ren Yi
1
25
1
1
304
Habli Hela
1
25
1
2
304
Mingyue Zheng
1
25
4
8
304
Kai-Chung Lau
1
25
2
3
304
Brahim Oujia
1
25
2
2
312
Trent E Balius
1
24
1
1
312
Robert C Rizzo
1
24
1
1
312
Sudipto Mukherjee
1
24
1
1
315
Yung-Ting Lee
2
32
1
1
315
Michio Katouda
1
23
1
2
315
Shao-Yu Lu
1
23
1
1
315
Shigeki Yamamoto
1
23
1
4
315
Masato Tanaka
1
23
1
1
315
Alexandre C B Delbem
1
23
1
1
315
Fernando Luís B Da Silva
1
23
1
1
322
Dmitry O Zharkov
1
22
1
3
322
Guo-Wei Wei
2
43
1
2
322
Axel Schild
1
22
1
1
322
Yiying Tong
1
22
2
2
322
Pekka Pyykkö
1
22
1
1
322
Krzysztof Z Łączkowski
1
22
1
1
322
Kelin Xia
1
22
1
2
322
Xin Feng
1
22
1
1
331
Jiří Kessler
1
21
1
2
331
Jean-Philip Piquemal
1
21
3
2
331
Szilvia Nagy
1
21
1
1
331
Yuji Sugita
1
21
3
6
331
Richard G Maroun
1
21
2
4
331
Jaewoon Jung
1
21
1
2
331
Jaehun Chun
1
21
1
3
331
Martin Dracinsky
1
21
3
6
331
Nathan A Baker
1
21
2
3
331
Takaharu Mori
1
21
1
2
331
Janos Pipek
1
21
1
1
331
Krystel El Hage
1
21
1
1
331
Zhan Chen
1
21
1
1
331
Zeina Hobaika
1
21
1
1
345
Min Zhang
1
20
1
1
345
Yanliang Ren
1
20
1
3
345
Yu-He Kan
1
20
4
6
345
Hong-Liang Xu
1
20
1
4
345
Marjana Novič
1
20
1
3
345
Andrej Perdih
1
20
1
4
345
Rong-Lin Zhong
1
20
2
4
345
Nikola Minovski
1
20
1
2
345
Ding Li
1
20
1
3
345
Jian Wan
1
20
1
3
355
Nagarajan Vaidehi
1
19
1
2
355
Abhinandan Jain
1
19
1
1
355
Pavel M Polestshuk
1
19
1
2
355
Sandeep Patel
1
19
2
2
355
Liang Xu
1
19
1
4
355
Manabu Kiguchi
1
19
2
10
355
Sílvia Ap Martins
1
19
1
3
355
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1
19
1
3
355
Jeffrey R Wagner
1
19
1
1
364
Paul J Dauenhauer
1
18
1
6
364
Ashwin Ramasubramaniam
1
18
1
4
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Ram Kinkar Roy
1
18
1
3
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Anthony Nash
1
18
1
2
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Yoonjoo Choi
1
18
1
2
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Martin J Paterson
1
18
1
4
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Michael Nilges
1
18
1
3
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Daniel Kam-Wah Mok
1
18
2
7
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1
18
1
1
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1
18
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1
18
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1
18
1
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1
18
1
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1
18
2
5
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1
18
2
2
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1
18
1
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1
18
1
1
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Soumen Saha
1
18
1
2
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Daniel K W Mok
1
18
1
2
364
Jin Yang
1
18
1
1
384
Jerzy Leszczynski
1
17
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11
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1
17
1
2
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Aleksandar Sabljic
1
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2
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Francisco B Pereira
1
17
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1
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2
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1
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1
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1
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1
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Mark P Waller
2
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1
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1
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2
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1
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1
16
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1
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7
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Christoph Scheurer
2
20
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1
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John Z H Zhang
1
16
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1
16
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1
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1
15
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1
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1
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1
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1
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1
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1
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1
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1
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1
14
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1
14
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1
14
3
5
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1
14
1
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Nitin Sharma
1
14
1
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1
14
1
1
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2
19
1
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Peter Comba
1
13
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5
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Bodo Martin
1
13
1
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Juan C Mejuto
1
13
2
3
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1
13
2
2
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Juan F Gálvez
1
13
1
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1
13
1
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1
13
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2
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1
13
1
1
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1
12
2
2
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1
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10
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1
12
1
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1
12
4
12
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Henry A Boateng
1
12
1
1
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1
12
1
1
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1
12
1
1
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1
12
2
4
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Marco De La Pierre
1
12
2
6
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Robert Krasny
1
12
1
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Jaroslaw Dziadek
1
12
2
7
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Juan A Valdivia
1
12
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1
12
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8
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1
12
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1
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1
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1
11
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11
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1
11
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1
11
2
4
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1
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1
11
1
3
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1
11
1
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1
11
1
1
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1
10
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3
16
1
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1
10
2
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Stephan N Steinmann
1
10
2
3
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George A Kaminski
1
10
1
1
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1
10
1
1
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1
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7
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1
9
1
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1
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1
9
2
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1
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1
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1
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1
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1
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1
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1
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1
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Hajime Okumura
1
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4
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Zoran D Matović
1
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2
4
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Halina Szatylowicz
1
8
1
1
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1
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1
3
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1
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1
5
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1
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1
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1
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1
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1
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1
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6
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1
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1
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2
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1
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1
7
1
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1
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1
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1
7
1
2
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2
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1
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484
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1
7
1
3
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1
7
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1
7
1
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1
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6
14
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1
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Josep M Porta
1
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2
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Mark A Olson
1
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1
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2
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1
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1
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1
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1
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3
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1
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Mohsen Chitsaz
1
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1
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1
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1
2
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1
6
2
3
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Enrico Macii
1
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1
1
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1
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1
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1
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1
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1
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1
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1
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1
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1
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1
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5
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1
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1
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5
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2
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1
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1
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1
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1
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1
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1
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1
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11
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1
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1
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2
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1
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1
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1
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1
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1
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1
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1
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1
8
556
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1
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1
2
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1
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1
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6
11
558
Peter Schreiner
1
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13
558
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1
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1
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1
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1
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1
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1
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1
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1
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10
570
Jun Suzuki
1
0
1
0
570
Ronald E Miller
1
0
1
3
570
Carlos Campana
1
0
1
2
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