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exaly
›
Authors
›
Anna I Krylov
›
top-authors
Anna I Krylov
Hebrew University of Jerusalem
260
(top 1%)
papers
21.4K
(top 1%)
citations
71
(top 1%)
h
-index
140
(top 1%)
g
-index
278
all documents
22.3K
doc citations
957
citing journals
105
times ranked
Top Authors (by citations)
#
Author
Articles
Citations
R ARank
R CRank
1
Martin Head-Gordon
12
7,746
10
5
2
YIhan Shao
12
7,482
8
2
3
C David Sherrill
10
6,924
7
3
4
Lyudmila V Slipchenko
16
6,752
2
1
5
Peter M W Gill
6
6,582
8
3
6
Chao-Ping Hsu
5
6,295
10
3
6
Vitaly A Rassolov
5
6,295
4
1
6
Nicholas A Besley
5
6,295
7
2
6
Troy Van Voorhis
5
6,295
19
2
10
Christian Ochsenfeld
4
6,293
20
4
10
Thomas R Furlani
4
6,293
1
1
12
Steven Gwaltney
5
5,932
7
3
14
Sergey V Levchenko
11
5,802
2
1
15
John M Herbert
5
5,795
10
1
16
Ryan P Steele
3
5,676
7
5
16
Jörg Kussmann
3
5,676
3
2
16
Alexis T Bell
3
5,676
64
5
16
WanZhen Liang
3
5,676
10
2
16
Barry D Dunietz
3
5,676
21
4
16
Joseph E Subotnik
3
5,676
24
4
16
Yousung Jung
3
5,676
49
5
16
Robert A Distasio Jr
3
5,676
15
5
16
Henry Lee Woodcock
3
5,676
17
16
26
Young Min Rhee
3
5,184
11
5
27
Shawn T Brown
2
5,158
35
5
27
Jing Kong
2
5,158
3
2
27
Gregory J O Beran
2
5,158
32
6
27
Rustam Z Khaliullin
2
5,158
11
4
27
Edina Rosta
2
5,158
39
4
27
Daniel M Chipman
2
5,158
7
2
27
Henry F Schaefer
2
5,158
136
10
27
Anthony D Dutoi
2
5,158
5
4
36
Ksenia B Bravaya
23
4,584
1
1
37
Xintian Feng
14
4,379
1
1
38
Evgeny Epifanovsky
13
3,831
1
1
39
Dmitry Zuev
10
3,697
1
1
40
Edward F C Byrd
5
3,666
8
3
41
Thomas-C Jagau
11
3,637
1
1
42
David Casanova
8
3,417
7
2
43
Arik Landau
5
3,378
6
1
44
Aaron M Lee
3
3,216
18
3
45
Prashant Uday Manohar
3
3,184
1
1
46
Arieh Warshel
3
3,180
17
1
47
Eric Jon Sundstrom
3
3,114
3
4
48
Tim Kowalczyk
3
3,107
5
4
49
Paul M Zimmerman
3
3,097
36
6
50
Shane R Yost
2
3,079
5
5
50
Christopher Cramer
2
3,079
126
10
50
Daniel S Lambrecht
2
3,079
15
8
50
John A Parkhill
2
3,079
12
7
50
Andreas W Hauser
2
3,079
19
4
50
Shaama Mallikarjun Sharada
2
3,079
12
5
50
Roberto Peverati
2
3,079
12
6
50
Eric J Berquist
2
3,079
4
2
50
Jaehoon Kim
2
3,079
6
2
50
Dirk R Rehn
2
3,079
11
4
50
Nicholas J Mayhall
2
3,079
16
6
50
Narbe Mardirossian
2
3,079
6
4
50
Xing Zhang
2
3,079
4
3
50
Matthew B Goldey
2
3,079
10
9
50
David W Small
2
3,079
9
6
50
Ka Un Lao
2
3,079
8
5
50
Jeng-Da Chai
2
3,079
8
4
50
Andreas Klamt
2
3,079
6
2
50
Michael Diedenhofen
2
3,079
2
2
50
Takashi Tsuchimochi
2
3,079
5
3
50
Magnus W D Hanson-Heine
2
3,079
9
2
50
Jan Wenzel
2
3,079
5
4
50
Donald G Truhlar
2
3,079
186
12
50
Alán Aspuru Guzik
2
3,079
141
15
50
Igor Ying Zhang
2
3,079
15
5
50
Alec F White
2
3,079
7
3
50
Shervin Fatehi
2
3,079
4
4
50
William Goddard
2
3,079
205
14
50
Aleksandr V Marenich
2
3,079
3
4
50
Keith Lawler
2
3,079
19
4
50
Ryan M Richard
2
3,079
11
11
50
Kristina D Closser
2
3,079
3
3
50
William A Goddard
2
3,079
134
14
50
Zhi-Qiang You
2
3,079
7
6
50
Yu-Chuan Su
2
3,079
1
1
50
Caroline M Krauter
2
3,079
6
4
50
Oleg Vydrov
2
3,079
1
1
50
Leif D Jacobson
2
3,079
4
4
50
Adrian W Lange
2
3,079
3
3
91
Debashree Ghosh
9
3,072
1
1
92
Mark S Gordon
2
2,661
53
12
93
Adèle D Laurent
3
2,607
24
2
94
Robert J Doerksen
1
2,597
48
1
94
Frerich J Keil
1
2,597
17
4
94
Andreas Heyden
1
2,597
54
4
94
Andrew C Simmonett
1
2,597
67
12
94
Baron Peters
1
2,597
54
4
99
Roi Baer
1
2,561
34
9
99
Jun Yang
1
2,561
22
4
99
Rollin A King
1
2,561
39
12
99
Yan Zhao
1
2,561
72
5
99
Edward G Hohenstein
1
2,561
51
10
99
Bernard R Brooks
1
2,561
68
16
99
Eric Neuscamman
1
2,561
25
2
99
Xin Xu
1
2,561
71
5
99
Roberto Olivares-Amaya
1
2,561
14
7
99
Deborah L Crittenden
1
2,561
13
3
99
Leslie Vogt
1
2,561
43
7
99
Kai Brandhorst
1
2,561
10
3
99
An Ghysels
1
2,561
21
5
99
Jing Kong
1
2,561
250
15
99
Mark Gordon
1
2,561
50
15
99
Tamar Stein
1
2,561
18
4
99
Florian Häse
1
2,561
76
10
99
Joerg Kussmann
1
2,561
1
1
99
Ben Albrecht
1
2,561
1
1
99
Ester Livshits
1
2,561
5
2
121
Alexander V Nemukhin
21
1,069
4
2
122
Sonia Coriani
13
1,006
10
57
123
Bella L Grigorenko
18
980
4
2
124
Marta L Vidal
11
965
2
2
125
Kaushik D Nanda
13
945
1
1
126
Stephen E Bradforth
10
891
6
5
127
Pavel Pokhilko
12
835
1
1
128
Samer Gozem
11
706
2
3
129
Andreas Dreuw
4
697
21
10
130
Felix Plasser
3
662
18
47
131
Anastasia O Gunina
4
659
1
33
132
Stefanie A Mewes
2
646
4
60
133
Maxim V Ivanov
6
633
7
1
134
Sahil Gulania
7
625
1
1
135
Naoto Ishikawa
2
619
10
4
135
Jan Florian
2
619
18
2
135
David Sherrill
2
619
1
1
138
Wojciech Skomorowski
5
610
3
1
139
Shirin Faraji
4
606
4
1
140
Teresa Head-Gordon
2
590
54
36
141
Marc de Wergifosse
3
566
6
2
142
Tomasz A Wesolowski
2
544
11
61
143
Abel Carreras
2
536
5
2
143
Hanjie Jiang
2
536
4
2
145
Josefine H Andersen
2
530
2
3
146
Sven Kähler
2
527
1
1
147
Nicole Bellonzi
1
518
8
6
147
Yuezhi Mao
1
518
31
18
147
Susi Lehtola
1
518
31
14
147
Katherine J Oosterbaan
1
518
7
5
147
James R Gayvert
1
518
2
2
147
Jeffrey B Neaton
1
518
179
83
147
Mario Hernández Vera
1
518
11
2
147
Sebastian Ehlert
1
518
148
58
147
Thomas Markovich
1
518
6
5
147
Yu Zhang
1
518
45
4
147
Kevin Carter-Fenk
1
518
8
7
147
Daniel S Levine
1
518
23
11
147
Marc P Coons
1
518
8
4
147
Jonathan Thirman
1
518
8
6
147
Qingguo Feng
1
518
21
4
147
Kevin J Koh
1
518
8
8
147
Kerwin Hui
1
518
2
2
147
Atsushi Yamada
1
518
23
3
147
Alexandre Tkatchenko
1
518
121
125
147
Yi-Pei Li
1
518
12
4
147
Hugh G A Burton
1
518
3
2
147
Ádám Jász
1
518
5
3
147
Dennis Barton
1
518
11
2
147
Alex J W Thom
1
518
32
9
147
Alan E Rask
1
518
3
3
147
Kuan-Yu Liu
1
518
6
6
147
Gábor János Tornai
1
518
4
3
147
Alan D Chien
1
518
6
3
147
Run R Li
1
518
5
4
147
Alexander A Kunitsa
1
518
5
2
147
Matthias Loipersberger
1
518
18
11
147
Fabijan Pavošević
1
518
18
5
147
Sharon Hammes-Schiffer
1
518
174
17
147
Triet S Nguyen
1
518
3
3
147
Alexander Zech
1
518
13
63
147
Romit Chakraborty
1
518
9
3
147
Jan-Michael Mewes
1
518
20
8
147
Elliot C Rossomme
1
518
9
4
147
Bang Cong Huynh
1
518
2
2
147
Daniel Lefrancois
1
518
6
4
147
Srimukh Prasad Veccham
1
518
7
7
147
Adam Rettig
1
518
8
8
147
Eloy Ramos-Cordoba
1
518
18
6
147
Zsuzsanna Benda
1
518
8
2
147
Jiashu Liang
1
518
8
8
147
Jonathon Witte
1
518
5
5
147
K Birgitta Whaley
1
518
53
15
147
Pierpaolo Morgante
1
518
7
2
147
Alexander C Paul
1
518
19
5
147
Cristina Elizabeth González-Espinoza
1
518
4
4
147
Saswata Dasgupta
1
518
7
3
147
Bhaskar Rana
1
518
5
5
147
Marcus D Liebenthal
1
518
4
4
147
Qinghui Ge
1
518
6
6
147
Norman M Tubman
1
518
17
7
147
Joonho Lee
1
518
33
17
147
Michael F Herbst
1
518
10
7
147
Zhen Tao
1
518
12
5
147
Maximilian Scheurer
1
518
43
15
147
C William Mccurdy
1
518
17
5
147
A Eugene Deprince, Iii
1
518
41
38
147
Adrian L Dempwolff
1
518
12
7
147
Maximilian F S J Menger
1
518
13
6
147
Diptarka Hait
1
518
24
17
147
István Ladjánszki
1
518
7
5
147
Kun Yao
1
518
7
4
147
Christopher J Stein
1
518
47
63
147
Aaditya Manjanath
1
518
7
3
147
Ying Zhu
1
518
2
2
147
Tarek Scheele
1
518
1
1
147
Peter F Mclaughlin
1
518
1
1
147
Manuel Hodecker
1
518
9
4
147
D Vale Cofer-Shabica
1
518
4
4
147
Tim Stauch
1
518
21
9
147
Jie Liu
1
518
4
1
147
J Wayne Mullinax
1
518
8
4
147
Garrette Paran
1
518
1
1
147
Vishikh Athavale
1
518
4
4
147
Gergely Gidofalvi
1
518
10
10
147
Stefan Prager
1
518
10
4
228
Musa Ahmed
9
510
15
12
230
Igor V Polyakov
12
474
3
3
231
R Benny Gerber
8
432
9
9
232
Oleg Kostko
7
426
8
9
233
Nadezhda V Korovina
2
377
4
3
233
Mark E Thompson
2
377
68
61
233
Jimmy Joy
2
377
4
3
236
Atanu Acharya
5
365
3
2
237
Massimo Olivucci
4
340
40
92
238
Roland H Lindh
4
310
28
85
239
Konstantin A Lukyanov
3
273
32
40
239
Alexey M Bogdanov
3
273
7
2
241
Spiridoula Matsika
4
259
11
4
242
Anatoly B Kolomeisky
3
248
18
13
242
Saptaparna Das
1
248
9
4
242
Ralf M Haiges
1
248
62
40
245
Celestino Angeli
2
244
26
120
245
Federico Melaccio
2
244
8
6
247
Maria G Khrenova
5
199
9
3
248
Nicolas Ferré
2
187
43
78
249
Ming-Feng Tu
2
177
5
5
249
Gilles Doumy
2
177
35
21
249
Ludvig Kjellsson
2
177
13
4
249
Richard D Schaller
2
177
96
91
249
Zhi-Heng Loh
2
177
31
35
249
Robin Santra
2
177
94
113
249
William Schlotter
2
177
28
53
249
Giacomo Coslovich
2
177
27
44
249
Linda Young
2
177
31
22
249
Yoshiaki Kumagai
2
177
71
38
249
Marc Simon
2
177
111
72
249
Stephen H Southworth
2
177
33
23
249
Tushar Debnath
2
177
19
86
249
Caroline Arnold
2
177
5
5
249
Michael Minitti
2
177
50
54
249
Jan-Erik Rubensson
2
177
55
23
249
Anne Marie March
2
177
29
20
249
M S Bin Mohd Yusof
2
177
1
1
267
Albert Stolow
1
164
60
45
267
Oliver Gessner
1
164
90
46
269
Alessio Valentini
1
161
55
86
269
Michael Filatov
1
161
27
18
269
Miquel Huix-Rotllant
1
161
15
8
269
Luis Manuel Frutos Gaite
1
161
47
81
273
Lucas Koziol
8
160
1
1
274
Barak Hirshberg
2
154
4
8
275
Eric Herbst
2
153
42
35
275
Christopher N Shingledecker
2
153
23
16
275
Ralf I Kaiser
2
153
74
43
278
Jake D Koralek
1
149
13
44
278
Ralph Welsch
1
149
13
7
278
Khadijeh Khalili
1
149
7
5
278
S P Moeller
1
149
50
37
278
Ludger Inhester
1
149
59
17
283
Sebastian Mai
2
144
37
98
284
Bernd Winter
2
140
50
54
284
Robert Seidel
2
140
26
30
286
John F Stanton
2
132
42
43
287
Hanna Reisler
4
131
4
8
288
Alexandre Barrozo
4
125
3
5
289
Jürgen Gauss
3
121
9
13
290
Mohamed Y El-Naggar
3
119
9
32
290
T Daniel Crawford
2
119
72
62
292
Paul G Wenthold
4
116
1
3
293
Marat Valiev
1
115
28
60
294
Hai Wang
2
112
40
63
294
Craig A Taatjes
2
112
48
65
296
Pavel Jungwirth
2
107
122
105
297
Matthew J Abplanalp
1
99
11
6
297
Tao Yang
1
99
57
34
299
Joel Bowman
2
96
54
62
300
Olexandr Isayev
1
95
76
110
301
Natalie Orms
3
92
1
1
301
Giovanni Meloni
1
92
19
10
301
Adam J Trevitt
1
92
56
20
304
Shuai Xu
1
89
4
3
304
Dmitry I Morozov
2
89
12
49
306
Valeriu Scutelnic
3
84
3
4
306
Joost VandeVondele
1
84
47
93
306
Zheyue Yang
3
84
4
4
306
Michael Epshtein
3
84
5
4
306
Stephen R Leone
3
84
56
165
306
Youn Jue Bae
3
84
19
53
312
Stella Stopkowicz
1
80
15
15
313
Mátyás I Pápai
3
79
30
62
313
Klaus B Møller
3
79
49
66
313
Shota Tsuru
3
79
5
5
316
Masha Y Niv
2
78
19
168
316
Kyril M Solntsev
2
78
20
32
318
Theresa L Windus
1
72
43
30
318
Daniel G A Smith
1
72
45
76
318
Cecilia Clementi
1
72
43
57
318
Taylor A Barnes
1
72
10
6
318
Dmitri Babikov
2
72
7
9
318
Shantenu Jha
1
72
41
32
318
Doaa Altarawy
1
72
13
8
318
Paul Saxe
1
72
8
7
318
Robert J Harrison
1
72
38
50
318
Jessica A Nash
1
72
8
5
318
Benjamin P Pritchard
1
72
22
45
318
Pradeep Gurunathan
1
72
3
3
318
Vijay S Pande
1
72
40
103
318
Pradeep Kumar Gurunathan
1
72
9
3
332
Richard Mabbs
3
71
3
4
333
Anastasia V Mamontova
2
70
4
3
334
Tirthendu Sen
3
68
1
1
336
Arman A Sadybekov
2
65
1
14
337
Marwa H Farag
1
64
8
3
338
Felix H Bangerter
2
62
1
1
339
Robert E Continetti
3
61
13
12
339
Bastiaan J. Braams
2
61
15
76
341
Alexandre Bergantini
1
54
21
12
342
Christopher G Elles
2
48
8
14
343
Dmytro Kosenkov
1
47
7
7
344
J Mathias Weber
3
46
10
23
344
Shuang Xu
2
46
3
3
346
Chao Yang
1
43
45
54
346
Eugene Vecharynski
1
43
4
2
346
Kadir Diri
1
43
4
7
349
Rasmus Faber
1
42
8
25
349
Andrei Sanov
3
42
7
10
351
Subodh C Tiwari
2
40
17
23
352
Ronit Sarangi
1
39
1
1
353
Vladislav V Verkhusha
1
38
74
149
354
Alexander Yu Smirnov
1
37
18
16
354
Yulia G Ermakova
1
37
26
62
354
Mikhail Baranov
1
37
58
59
354
Baleeva Ns
1
37
27
34
358
Sanford Ruhman
2
35
11
23
359
Prem P Chapagain
1
32
36
49
359
Wolfram Sander
1
32
45
52
359
Sugumar Venkataramani
1
32
17
7
359
Vladimir A Mironov
1
32
19
39
359
M-A Gaveau
1
32
25
15
364
Stephen J Klippenstein
1
31
94
154
364
Lawrence B Harding
1
31
24
52
364
Maria V Makarova
1
31
2
1
367
Eric A Haugen
1
29
3
6
367
Yuki Kobayashi
1
29
10
33
369
Luis Velarde
1
28
14
32
369
Amanda L Houk
1
28
3
5
369
Allan East
1
28
7
7
369
E Siva Subramaniam Iyer
1
28
4
4
373
Bernd Abel
1
27
54
81
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Daniil Izmodenov
1
27
1
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373
Uwe Hergenhahn
1
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121
153
376
Jonathan R Church
1
26
8
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376
Aditya G Rao
1
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14
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Jógvan Magnus Haugaard Olsen
1
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51
115
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Michalis Lazaratos
1
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4
11
376
Veniamin A Borin
1
26
16
80
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Igor Schapiro
1
26
123
193
376
Avishai Barnoy
1
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4
12
376
Suliman Adam
1
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16
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1
26
2
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1
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12
21
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1
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22
41
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Luca De Vico
1
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37
90
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Yigal Lahav
1
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1
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39
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1
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1
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1
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77
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Maria Andrea Mroginski
1
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55
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1
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54
130
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Jacob Kongsted
1
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105
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PaweŁ WÓjcik
1
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Ilia A Solov'yov
1
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34
49
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Laura Pedraza-González
1
26
14
44
376
Lukas Kemmler
1
26
2
2
376
Christian Wiebeler
1
26
17
31
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Ronald Gonzalez
1
26
1
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Ana-Nicoleta Bondar
1
26
51
119
376
Rajiv Kumar Kar
1
26
47
79
376
Alberto Pérez De Alba Ortíz
1
26
5
3
376
Gil S Amoyal
1
26
6
6
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1
26
1
1
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1
26
1
1
408
Adrian G Amador
1
23
3
7
409
Maristella Alessio
2
21
3
14
410
Leah G Dodson
1
20
6
17
410
Mitchio Okumura
1
20
33
78
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Felix Castellano
1
20
105
193
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Rony S Khnayzer
1
20
36
56
410
Robin J Shannon
1
20
18
46
410
Ksenija D Glusac
1
20
31
47
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Guo-Zhu Zhu
1
20
10
11
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Hoi Ling Luk
1
20
25
73
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David Glowacki
1
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42
92
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Eric R Hudson
1
20
21
22
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Christopher M Hadad
1
20
94
133
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David L Osborn
1
20
33
46
410
Xin Yang
1
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9
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Dapeng Zhou
1
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9
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Janitha Walpita
1
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7
9
425
Frederick R Manby
1
19
36
70
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Filipp Furche
1
19
65
127
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1
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55
114
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Chris -Kriton Skylaris
1
19
67
120
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Peter Pulay
1
19
17
39
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Peter J Knowles
1
19
18
70
431
Xue-Bin Wang
1
18
91
90
431
Artyom A Astafiev
1
18
11
13
431
Ekram Hossain
1
18
9
15
431
Aleksander M Shakhov
1
18
13
12
435
Henrik Koch
1
17
64
131
435
Eirik Fadum Kjønstad
1
17
9
21
437
Qian Yang
1
16
4
7
437
Sapna Sarupria
1
16
14
25
437
Yusu Wang
1
16
12
28
437
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1
16
53
73
437
Aurora Clark
1
16
50
64
437
Stefan M Wild
1
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29
63
437
Henry Adams
1
16
3
2
437
Anders M N Niklasson
1
16
22
68
437
Carol A Parish
1
16
23
56
446
James E T Smith
1
14
5
64
446
Elizabeth C Carroll
1
14
18
47
446
Mikas Vengris
1
14
13
17
446
Delmar S Larsen
1
14
30
76
450
Yingying
1
13
3
3
451
Guosheng Li
2
12
27
106
452
Dmitriy Bezrukov
1
11
23
24
453
Saikiran Kotaru
1
9
1
4
453
Goran Giudetti
1
9
2
2
455
Shmuel Zilberg
1
8
13
28
455
Ekaterina D Kots
1
8
11
17
457
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1
7
3
4
457
C Annie Hart
1
7
2
2
457
Julia R Lazzari-Dean
1
7
3
7
457
Ravin Fernando
1
7
8
9
461
Bo Xu
1
6
28
31
461
Kevin R Wilson
1
6
41
152
461
Michael I Jacobs
1
6
12
14
464
Eleanor Castracane
1
5
9
9
464
J A Gibbard
1
5
8
10
464
Oleg Prezhdo
2
5
115
325
464
Jiri Brabec
1
5
28
83
464
Andrey F Vilesov
2
5
35
82
464
Curt Wittig
3
5
4
9
470
Kang-Kuen Ni
1
4
35
59
471
V A Skuratov
1
3
64
103
472
Parmeet Nijjar
1
1
2
17
473
Knut R Asmis
1
0
79
165
473
Anne B Mccoy
1
0
200
267
473
Roland Wester
1
0
114
198
473
Kenneth D Jordan
1
0
73
154
473
Martin K Beyer
1
0
58
98
473
Valérie Gabelica
1
0
97
220
473
Scott A Reid
1
0
30
57
473
Marie-Pierre Gaigeot
1
0
60
123
473
Peter Sarre
1
0
1
106
473
Stefan Willitsch
1
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41
87
473
Jan R r Verlet
1
0
51
114
473
James N Bull
1
0
34
102
473
Michael Gatchell
1
0
70
359
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