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Author
Articles
Citations
R ARank
R CRank
1
Shane R Yost
1
2,561
1
1
1
Christopher Cramer
1
2,561
3
2
1
Daniel S Lambrecht
1
2,561
3
2
1
John A Parkhill
1
2,561
1
1
1
Sergey V Levchenko
1
2,561
1
1
1
Thomas-C Jagau
1
2,561
2
2
1
Anna I Krylov
1
2,561
4
4
1
Mark S Gordon
1
2,561
3
3
1
Andreas W Hauser
1
2,561
1
1
1
Shawn T Brown
1
2,561
2
1
1
Shaama Mallikarjun Sharada
1
2,561
1
1
1
Roberto Peverati
1
2,561
2
2
1
Arieh Warshel
1
2,561
2
2
1
Eric J Berquist
1
2,561
2
2
1
Roi Baer
1
2,561
3
1
1
Jaehoon Kim
1
2,561
1
1
1
Jun Yang
1
2,561
2
2
1
YIhan Shao
2
2,584
1
2
1
Dirk R Rehn
1
2,561
1
1
1
Adèle D Laurent
1
2,561
1
1
1
Prashant Uday Manohar
1
2,561
1
1
1
Lyudmila V Slipchenko
1
2,561
2
2
1
Jing Kong
1
2,561
1
1
1
Rollin A King
1
2,561
3
3
1
Yan Zhao
1
2,561
1
1
1
Nicholas J Mayhall
1
2,561
2
2
1
Narbe Mardirossian
1
2,561
2
2
1
John M Herbert
1
2,561
4
4
1
Xing Zhang
1
2,561
2
2
1
Arik Landau
1
2,561
1
1
1
Edward G Hohenstein
1
2,561
3
3
1
Gregory J O Beran
1
2,561
3
2
1
Matthew B Goldey
1
2,561
2
2
1
Young Min Rhee
1
2,561
2
2
1
Ryan P Steele
1
2,561
1
1
1
David W Small
1
2,561
1
1
1
Evgeny Epifanovsky
1
2,561
2
2
1
Bernard R Brooks
1
2,561
4
3
1
Ka Un Lao
1
2,561
2
2
1
Jeng-Da Chai
1
2,561
2
2
1
Christian Ochsenfeld
1
2,561
2
1
1
Martin Head-Gordon
1
2,561
5
4
1
Thomas R Furlani
1
2,561
1
1
1
Jörg Kussmann
1
2,561
1
1
1
Eric Neuscamman
1
2,561
1
1
1
Ksenia B Bravaya
1
2,561
4
3
1
Xin Xu
1
2,561
3
2
1
Andreas Klamt
1
2,561
1
1
1
C David Sherrill
1
2,561
3
3
1
Michael Diedenhofen
1
2,561
1
1
1
Alexis T Bell
1
2,561
2
2
1
WanZhen Liang
1
2,561
4
1
1
Roberto Olivares-Amaya
1
2,561
2
2
1
Takashi Tsuchimochi
1
2,561
2
2
1
Magnus W D Hanson-Heine
1
2,561
2
2
1
Deborah L Crittenden
1
2,561
2
1
1
Jan Wenzel
1
2,561
1
1
1
Barry D Dunietz
1
2,561
1
1
1
Leslie Vogt
1
2,561
1
1
1
Kai Brandhorst
1
2,561
1
1
1
Chao-Ping Hsu
1
2,561
3
2
1
Vitaly A Rassolov
1
2,561
2
2
1
Paul M Zimmerman
1
2,561
2
2
1
Donald G Truhlar
1
2,561
4
3
1
Alán Aspuru Guzik
1
2,561
3
3
1
Igor Ying Zhang
1
2,561
1
1
1
David Casanova
1
2,561
4
4
1
Rustam Z Khaliullin
1
2,561
1
1
1
Alec F White
1
2,561
3
2
1
Edina Rosta
1
2,561
5
1
1
Shervin Fatehi
2
2,627
1
1
1
Eric Jon Sundstrom
1
2,561
1
1
1
Daniel M Chipman
1
2,561
1
1
1
An Ghysels
1
2,561
1
1
1
William Goddard
1
2,561
5
2
1
Henry F Schaefer
1
2,561
4
3
1
Aleksandr V Marenich
1
2,561
1
1
1
Jing Kong
1
2,561
5
1
1
Debashree Ghosh
1
2,561
1
1
1
Nicholas A Besley
1
2,561
2
2
1
Peter M W Gill
1
2,561
2
2
1
Keith Lawler
1
2,561
1
1
1
Tim Kowalczyk
1
2,561
1
1
1
Joseph E Subotnik
2
2,627
3
3
1
Mark Gordon
1
2,561
2
2
1
Yousung Jung
1
2,561
1
1
1
Robert A Distasio Jr
1
2,561
2
2
1
Tamar Stein
1
2,561
1
1
1
Henry Lee Woodcock
1
2,561
2
2
1
Florian Häse
1
2,561
2
2
1
Steven Gwaltney
1
2,561
2
2
1
Ryan M Richard
1
2,561
1
1
1
Troy Van Voorhis
1
2,561
2
2
1
Kristina D Closser
1
2,561
2
2
1
Xintian Feng
1
2,561
2
2
1
William A Goddard
1
2,561
3
2
1
Zhi-Qiang You
1
2,561
3
3
1
Yu-Chuan Su
1
2,561
1
1
1
Caroline M Krauter
1
2,561
2
2
1
Oleg Vydrov
1
2,561
1
1
1
Joerg Kussmann
1
2,561
1
1
1
Ben Albrecht
1
2,561
1
1
1
Ester Livshits
1
2,561
1
1
1
Leif D Jacobson
1
2,561
1
1
1
Anthony D Dutoi
1
2,561
1
1
1
Adrian W Lange
1
2,561
1
1
1
Dmitry Zuev
1
2,561
2
2
115
Peter J Stang
12
2,827
1
1
115
Timothy Cook
7
2,710
1
1
117
Xuzhou Yan
3
869
2
2
117
Pi Wang
1
597
2
1
117
Feihe Huang
2
857
2
2
120
David B Mitzi
1
372
2
3
120
David S Ginley
1
372
1
1
120
Joel S Miller
6
402
1
1
120
Leeor Kronik
1
372
2
2
120
Seth R Marder
1
372
6
3
120
Gary Hodes
1
372
2
2
120
David Cahen
1
372
3
2
120
Michael F Toney
1
372
5
2
120
David A Egger
1
372
7
5
120
Antoine Kahn
1
372
6
4
120
Boris Rybtchinski
1
372
2
1
120
Yueh-Lin Loo
1
372
4
5
120
Vladan Stevanović
1
372
1
1
120
Yitzhak Mastai
1
372
2
2
120
Michael F Toney
1
372
6
4
120
Yaron Paz
1
372
1
1
120
David Zitoun
1
372
2
2
120
Joseph Berry
1
372
5
3
120
Andrew M Rappe
1
372
6
3
120
Tonio Buonassisi
1
372
3
7
140
Zhixuan Zhou
3
298
1
1
140
Cory E Hauke
1
260
1
1
140
Xiaopeng Li
1
260
2
8
140
Ming Wang
1
260
2
1
140
Manik Lal Saha
4
322
1
1
140
Mingming Zhang
1
260
2
1
146
Tamsin L Malkin
1
215
3
3
146
Christoph G Salzmann
1
215
4
3
146
Thomas F Whale
1
215
5
8
146
Benjamin J Murray
1
215
5
7
146
Valeria Molinero
6
581
1
1
151
Francisco Dean Toste
1
185
3
4
151
Matthew S Sigman
11
1,031
1
1
151
Anat Milo
1
185
1
1
151
Andrew J Neel
1
185
1
1
156
Andrew Huy Nguyen
3
280
1
1
157
Jennifer M Crawford
1
158
1
1
158
Jong-Won Park
1
154
1
1
158
Jennifer S Shumaker-Parry
2
177
1
1
160
Jing Fan
1
152
1
2
160
Xin Teng
1
152
1
1
160
Ryan E Looper
4
183
1
1
160
Ling Liu
1
152
1
1
160
Katherine R Mattaini
1
152
1
1
165
Cynthia J Burrows
13
623
1
1
165
Jia Zhou
2
254
1
1
165
Aaron M Fleming
11
571
1
1
165
Jia Zhou
2
254
1
1
165
Susan S Wallace
2
254
1
1
170
Hui-Juan Yan
1
117
1
1
170
Li-Jun Wan
1
117
2
2
170
Dong Wang
1
117
3
2
170
Ting Chen
1
117
2
1
170
Xuan-He Liu
1
117
1
1
175
Qianjin Chen
3
239
1
1
175
Sean R German
3
225
1
1
175
Henry S White
10
605
1
1
178
Ashish Thakur
2
129
1
1
178
Janis Louie
3
146
1
1
180
Lisa M Berreau
1
96
1
1
180
Abby D Benninghoff
1
96
1
1
182
Yang Ye
2
140
1
1
182
Jing Wu
2
140
1
1
182
Shijun Li
2
140
1
1
185
David P Hickey
3
174
1
1
185
Shelley D Minteer
7
385
1
1
185
Vaneet Saini
1
91
1
1
185
Ivana Matanovic
1
91
1
1
185
Plamen Atanassov
1
91
3
5
190
Ling Zang
1
83
2
2
191
Mario R Capecchi
2
152
2
2
192
Long Luo
1
77
1
1
193
Pavel A Zhizhko
1
76
1
1
193
Christophe Coperet
1
76
2
3
193
Elizabeth N Bess
2
121
1
1
193
Victor Mougel
1
76
2
2
197
J Michael Gee
1
72
3
3
197
Petr Tvrdik
1
72
3
3
197
Sierra Palumbos
1
72
3
3
197
Ben Xu
1
72
1
1
201
Yun Ding
3
121
1
1
202
C Dale Poulter
4
126
1
1
202
John E Cronan
1
69
1
1
202
Steven C Almo
2
111
2
8
202
Gurusankar Ramamoorthy
3
114
1
1
206
Alexander von Weber
2
122
1
1
206
Scott L Anderson
10
292
1
1
208
Qi Ou
1
66
2
3
209
Tricia D Shepherd
1
65
1
1
209
He Wang
1
65
1
1
209
Luisa Whittaker-Brooks
1
65
1
1
209
Graham R Fleming
1
65
2
3
209
He Wang
1
65
1
1
209
Matthew A Koc
1
65
1
1
215
Fabien Giroud
1
63
1
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R D Milton
3
146
1
1
217
Yuqing Qiu
1
62
1
1
218
Dayi Chen
2
116
1
1
218
Matthew R Hermes
1
61
2
2
218
Jack Simons
1
61
1
1
218
Joseph Ortiz
1
61
2
2
218
So Hirata
1
61
2
2
218
J V Ortiz
1
61
2
2
224
Martin A Edwards
4
159
1
1
224
Thure E Cerling
1
59
3
5
224
Jeffrey E Dick
1
59
2
3
224
Allen J Bard
1
59
4
9
224
Fiona B Marshall
1
59
1
1
229
Haitao Ji
4
140
1
1
229
Yongqiang Zhang
2
113
1
1
231
Lei Liu
1
56
1
1
231
Ke-Li Han
1
56
1
3
231
Junsheng Chen
1
56
1
2
231
Yang Yang
1
56
1
1
231
Francis Sloan Roberts
3
84
1
2
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Shiv Khanna
1
56
2
2
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Arthur C Reber
1
56
3
2
231
Jian-Yong Liu
1
56
2
2
231
Guangjiu Zhao
1
56
1
1
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Huw M L Davies
1
45
2
2
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Shaun Ard
1
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5
5
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Nicholas S Shuman
1
44
5
5
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Joshua J Melko
1
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5
5
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Jungsoo Kim
1
44
1
1
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Albert A Viggiano
1
44
5
5
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Richard M Cox
2
78
1
1
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Peter Armentrout
7
176
1
1
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Michael C Heaven
1
44
2
2
250
Robert P Johnson
2
64
1
1
251
Nathan D Kirchhofer
1
42
1
1
251
Matthew Jacobson
2
45
3
5
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Guillermo C Bazan
1
42
4
8
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Bo-Xue Tian
2
45
1
1
255
Jindřich Kopeček
2
69
2
2
255
Te-Wei Chu
2
69
2
2
255
Jiyuan Yang
2
69
2
2
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Ki-Whan Chi
1
36
2
3
258
Abhishek Dubey
1
36
2
2
260
Sanjoy Bandyopadhyay
1
34
2
2
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Prabir Khatua
1
34
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2
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Wibe A De Jong
1
34
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Debdas Dhabal
1
34
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Murari Singh
1
34
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1
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Charusita Chakravarty
1
34
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2
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Jos Oomens
2
60
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4
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Giel Berden
2
60
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2
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Bern Kohler
1
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Eric Mayo Peterson
1
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Joel M Harris
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69
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Jennifer M Heemstra
1
31
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Roberto Improta
1
31
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3
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Jordan Dood
1
31
1
1
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Ghanshyam L Vaghjiani
1
29
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1
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Jesus Paulo Perez
1
29
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1
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Zuoli He
1
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1
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Dengqing Zhang
1
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1
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Ji Yeon Ryu
2
43
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2
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Li-Ping Xu
1
24
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2
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Olaf Wiest
1
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10
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Damian A Scherlis
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Junseong Lee
2
43
3
3
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Benjamin Buckley
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3
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Bin Cheng
1
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Margaret J Hilton
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24
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Liping Xu
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Steve Blair
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1
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Peng Tao
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Ye Mei
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Alexander J Sodt
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Ilya Zharov
2
38
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1
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Gerhard König
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1
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Sidney Aquino Neto
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A R De Andrade
1
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1
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Oscar W Wheeler
1
21
1
1
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Jerry A Boatz
1
21
1
1
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Rachel M Vaden
1
20
1
1
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Justin M Salvant
1
20
1
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Bryan E Welm
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Min Hyung Lee
1
19
3
3
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George R Pettit
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17
2
2
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Noemi Kedei
1
17
1
1
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Matthew B Kraft
1
17
1
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Peter B Armentrout
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16
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1
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Assunta Morresi
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1
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Ramin Dubey
1
15
1
1
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Silvia Corezzi
1
15
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1
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1
15
1
3
307
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1
15
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2
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1
15
2
5
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1
15
1
2
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2
24
1
1
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Bryan A Long
2
26
1
1
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Dieter Gerlich
1
13
3
6
315
Jeremy T O'brien
1
13
1
2
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James La Clair
1
12
3
5
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Myriam Seemann
1
12
1
1
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1
12
1
2
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1
12
1
1
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1
12
1
4
318
Jon D Rainier
3
28
1
1
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Hai Wang
2
20
2
10
324
Bin Yang
1
10
1
3
324
Randall E Winans
1
10
1
1
324
Juan Wang
1
10
1
1
324
Srinivas R Paladugu
1
10
1
1
329
Timothy G Wright
3
19
2
2
329
Michael D Morse
2
16
1
1
329
Fernando Mota
1
9
1
1
329
Juan J Novoa
1
9
1
1
329
Arnold L Rheingold
2
9
5
30
334
Ilia A Guzei
1
5
3
3
334
Rameshu Rallabandi
1
5
1
1
334
Somnath Jana
1
5
1
1
337
Kevin H Stone
1
4
1
7
338
Joe P Harris
1
2
2
2
339
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1
1
2
2
339
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1
1
1
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