About
Technology
Issues
FAQ
Search
Profile
Top Authors
Prolific Authors
Top Journals
Main Disciplines
Main Topics
Most Cited Articles
Scientometrics
Avg Impact Factor
★★
Articles
★★★
Articles
Citing Bodies
Top Citing Authors
Top Citing Institutions
Top Citing Schools
Top Citing Journals
Top Citing Disciplines
exaly
›
Schools
›
Department of Chemistry
›
top-authors
Department of Chemistry
5.6K
(top 0.1%)
papers
305.5K
(top 0.1%)
citations
218
(top 0.1%)
h
-index
358
(top 0.1%)
g
-index
6.2K
all documents
320.6K
doc citations
6.5K
citing journals
Top Authors (by citations)
#
Author
Articles
Citations
R ARank
R CRank
1
Gary A Molander
209
21,222
1
1
2
Andrew M Rappe
259
20,621
1
1
3
Christopher B Murray
140
15,147
1
1
4
Michael L Klein
69
12,167
1
2
5
David W Christianson
141
12,059
1
1
6
Virgil Percec
117
11,559
1
1
7
Marisa C Kozlowski
124
8,588
1
1
8
Joseph E Subotnik
117
7,069
1
1
9
Xingchen Ye
25
6,218
1
1
10
Douglas J Tobias
8
6,200
5
1
11
Patrick J Walsh
145
5,899
1
1
12
Michael J Therien
80
5,346
2
1
13
Cherie R Kagan
51
4,855
2
2
14
Eric J Schelter
125
4,621
1
1
15
William F Degrado
42
3,984
2
3
16
Ilya Grinberg
45
3,983
1
1
17
Gregory A Voth
48
3,930
4
4
18
Tobias Baumgart
48
3,693
1
1
19
Ivan Dmochowski
87
3,513
1
1
20
Matteo Cargnello
25
3,454
2
1
21
Marsha I Lester
99
3,421
1
1
22
David N Primer
11
3,403
1
1
23
Patrick Carroll
134
3,381
1
1
24
Shervin Fatehi
10
3,365
1
1
25
Thomas R Gordon
13
3,352
1
1
26
John C Tellis
11
3,319
1
1
27
Robert A Distasio Jr
3
3,274
7
3
28
YIhan Shao
8
3,251
7
4
29
Jeffrey D Winkler
62
3,246
1
1
30
B J Berne
4
3,136
3
3
31
WanZhen Liang
3
3,082
7
3
32
Shane R Yost
2
3,079
3
3
32
Christopher Cramer
2
3,079
27
9
32
Daniel S Lambrecht
2
3,079
6
5
32
John A Parkhill
2
3,079
5
3
32
Thomas-C Jagau
2
3,079
5
3
32
Anna I Krylov
2
3,079
15
9
32
Andreas W Hauser
2
3,079
2
2
32
Shaama Mallikarjun Sharada
2
3,079
6
3
32
Roberto Peverati
2
3,079
6
5
32
Eric J Berquist
2
3,079
3
2
32
Jaehoon Kim
2
3,079
1
1
32
Dirk R Rehn
2
3,079
3
2
32
Prashant Uday Manohar
2
3,079
2
2
32
Lyudmila V Slipchenko
2
3,079
9
4
32
Nicholas J Mayhall
2
3,079
5
2
32
Narbe Mardirossian
2
3,079
4
3
32
John M Herbert
2
3,079
9
8
32
Xing Zhang
2
3,079
6
5
32
Arik Landau
2
3,079
5
2
32
Matthew B Goldey
2
3,079
3
2
32
Ryan P Steele
2
3,079
4
3
32
David W Small
2
3,079
2
2
32
Evgeny Epifanovsky
2
3,079
4
3
32
Ka Un Lao
2
3,079
4
3
32
Jeng-Da Chai
2
3,079
5
5
32
Christian Ochsenfeld
2
3,079
8
4
32
Martin Head-Gordon
2
3,079
19
10
32
Thomas R Furlani
2
3,079
5
4
32
Jörg Kussmann
2
3,079
2
2
32
Ksenia B Bravaya
2
3,079
5
4
32
Andreas Klamt
2
3,079
1
1
32
Michael Diedenhofen
2
3,079
2
2
32
Alexis T Bell
2
3,079
8
4
32
Takashi Tsuchimochi
2
3,079
3
2
32
Magnus W D Hanson-Heine
2
3,079
4
4
32
Jan Wenzel
2
3,079
2
2
32
Barry D Dunietz
2
3,079
13
5
32
Chao-Ping Hsu
2
3,079
13
6
32
Vitaly A Rassolov
2
3,079
7
6
32
Paul M Zimmerman
2
3,079
11
5
32
Donald G Truhlar
2
3,079
33
8
32
Alán Aspuru Guzik
2
3,079
32
9
32
Igor Ying Zhang
2
3,079
8
4
32
David Casanova
2
3,079
15
4
32
Alec F White
2
3,079
7
5
32
Eric Jon Sundstrom
2
3,079
3
3
32
William Goddard
2
3,079
31
9
32
Aleksandr V Marenich
2
3,079
3
3
32
Nicholas A Besley
2
3,079
12
5
32
Peter M W Gill
2
3,079
10
6
32
Keith Lawler
2
3,079
8
2
32
Tim Kowalczyk
2
3,079
7
4
32
Yousung Jung
2
3,079
19
6
32
Henry Lee Woodcock
2
3,079
7
9
32
Ryan M Richard
2
3,079
9
6
32
Troy Van Voorhis
2
3,079
12
6
32
Kristina D Closser
2
3,079
2
2
32
Xintian Feng
2
3,079
3
3
32
William A Goddard
2
3,079
22
8
32
Zhi-Qiang You
2
3,079
5
4
32
Yu-Chuan Su
2
3,079
1
1
32
Caroline M Krauter
2
3,079
2
2
32
Oleg Vydrov
2
3,079
1
1
32
Leif D Jacobson
2
3,079
3
2
32
Adrian W Lange
2
3,079
3
2
32
Dmitry Zuev
2
3,079
4
3
101
Paolo Fornasiero
15
3,052
1
1
102
Vicky V T Doan-Nguyen
14
3,004
1
1
103
Feng Gai
70
2,968
1
1
105
Charles Kane
10
2,841
2
3
106
Shi Liu
32
2,803
1
1
107
Ronen Marmorstein
33
2,801
2
1
108
Sergey V Levchenko
6
2,728
2
3
109
Jeffery G Saven
72
2,724
1
1
110
E James Petersson
82
2,720
1
1
111
Mark E Tuckerman
8
2,709
3
4
112
Madeleine M Joullié
114
2,667
1
1
113
Young Min Rhee
2
2,568
8
3
114
Mark S Gordon
1
2,561
31
10
114
Shawn T Brown
1
2,561
17
6
114
Arieh Warshel
1
2,561
11
5
114
Roi Baer
1
2,561
17
4
114
Jun Yang
1
2,561
10
6
114
Adèle D Laurent
1
2,561
7
3
114
Jing Kong
1
2,561
4
2
114
Rollin A King
1
2,561
15
8
114
Yan Zhao
1
2,561
20
6
114
Edward G Hohenstein
1
2,561
18
7
114
Gregory J O Beran
1
2,561
14
4
114
Bernard R Brooks
1
2,561
22
9
114
Eric Neuscamman
1
2,561
8
4
114
Xin Xu
1
2,561
15
3
114
C David Sherrill
1
2,561
28
13
114
Roberto Olivares-Amaya
1
2,561
3
3
114
Deborah L Crittenden
1
2,561
6
3
114
Leslie Vogt
1
2,561
8
3
114
Kai Brandhorst
1
2,561
2
2
114
Rustam Z Khaliullin
1
2,561
9
2
114
Edina Rosta
1
2,561
15
4
114
Daniel M Chipman
1
2,561
2
2
114
An Ghysels
1
2,561
3
1
114
Henry F Schaefer
1
2,561
54
11
114
Jing Kong
1
2,561
58
10
114
Debashree Ghosh
1
2,561
7
4
114
Mark Gordon
1
2,561
16
7
114
Tamar Stein
1
2,561
5
2
114
Florian Häse
1
2,561
17
9
114
Steven Gwaltney
1
2,561
19
7
114
Joerg Kussmann
1
2,561
1
1
114
Ben Albrecht
1
2,561
1
1
114
Ester Livshits
1
2,561
3
1
114
Anthony D Dutoi
1
2,561
5
3
152
Daniela A Wilson
10
2,502
2
1
153
Liangzheng Tan
22
2,497
1
1
154
Raymond J Gorte
20
2,478
1
2
155
Eric Meggers
26
2,419
2
1
156
Leeor Kronik
15
2,280
2
2
157
David A Egger
12
2,278
4
3
158
Joseph G Sodroski
39
2,245
1
4
159
Eric Stach
14
2,191
7
8
160
Mihai Peterca
29
2,165
1
2
161
Christopher B Kelly
20
2,138
2
1
162
Fan Zheng
16
2,129
1
1
163
Taejong Paik
15
2,100
1
1
164
Jianshu Cao
14
2,067
2
2
165
Carlo Ballatore
39
2,054
1
2
166
Na Zhang
9
2,038
2
1
166
Jeffrey W Bode
29
2,038
2
3
168
Eugene J Mele
13
2,022
2
3
169
Barry S Cooperman
50
1,902
1
1
170
Jennifer K Matsui
16
1,901
1
1
171
Dong Yang
5
1,880
4
3
171
Angang Dong
5
1,880
3
3
173
Luigi Di Costanzo
23
1,842
1
1
174
Shorouk O Badir
19
1,833
1
1
175
David Chandler
11
1,829
4
4
176
Amos B Smith, Iii
58
1,813
1
1
177
Manho Lim
9
1,755
3
1
178
David E Cane
21
1,739
3
4
179
Frank S Bates
6
1,723
3
3
180
Yijin Kang
9
1,719
1
5
181
Yung Sam Kim
16
1,712
1
1
181
Benjamin T Diroll
30
1,712
1
1
183
Ryan R Walvoord
8
1,695
1
1
184
Abrahan Nitzan
53
1,645
2
4
185
Youngkuk Kim
13
1,641
1
1
186
Peter Hamm
10
1,598
3
2
187
Daniel A Hammer
17
1,573
2
6
188
David M Chenoweth
57
1,569
1
1
189
Zahra Fakhraai
52
1,552
1
1
190
Dmitri V Talapin
2
1,547
15
5
191
Carol A Fierke
13
1,522
3
3
192
Osvaldo Gutierrez
20
1,520
2
1
193
Bradford B Wayland
42
1,515
1
1
194
Michael J Monteiro
7
1,503
3
3
195
Jonathan E Spanier
5
1,486
5
3
196
So-Jung Park
29
1,458
1
1
197
Andrew Akbashev
2
1,445
5
1
198
Ana-Maria Resmerita
4
1,443
1
1
199
Shelley L Berger
6
1,439
7
11
200
Gerard Lligadas
20
1,426
2
1
200
Peter K Davies
7
1,426
2
2
202
Dennis E Discher
11
1,408
2
7
203
Daniel J Mindiola
64
1,407
1
2
204
Ravi K Amaravadi
11
1,390
5
299
205
Goran Ungar
15
1,386
2
2
206
Neil K Garg
4
1,368
3
2
207
Steve M Young
9
1,362
1
1
208
Gaoyang Gou
3
1,351
1
1
209
Simon B Lang
7
1,344
1
1
210
Xiang-bing Zeng
16
1,334
2
2
211
Jessica M Anna
11
1,324
1
1
212
Michiel Sprik
9
1,312
2
2
213
Nader Engheta
8
1,265
6
3
214
John Trojanowski
28
1,246
10
140
215
Robert B Wexler
9
1,229
1
1
216
Tamaz Guliashvili
3
1,221
4
1
217
Kyriacos C Nicolaou
33
1,210
5
5
218
Andrés Finzi
26
1,198
2
2
219
Wataru Shinoda
7
1,191
4
1
220
Efrat Lifshitz
2
1,176
5
2
221
Goundla Srinivas
8
1,174
1
1
222
James P Phelan
7
1,154
1
1
223
Lane Martin
10
1,153
6
8
224
Jun Chen
3
1,150
2
1
225
Guozhong Xing
3
1,149
9
3
226
Emad Aqad
8
1,117
2
1
227
Liyan Wu
1
1,110
6
3
227
Guannan Chen
1
1,110
2
2
227
Yuzhi Gao
2
1,110
2
1
230
Matthew J Tucker
20
1,081
1
1
231
Benjamin J Wieder
3
1,072
7
3
232
Jianyou Mao
24
1,053
2
1
233
Fenggong Wang
10
1,048
1
1
234
Hai-Lung Dai
46
1,045
2
2
235
Kurt R Brunden
23
1,044
1
4
235
Thomas E Mallouk
23
1,044
2
6
237
Humeyra Caglayan
3
1,043
4
1
238
Peter I Lelkes
2
1,040
12
3
239
Darrin J Pochan
19
1,022
3
3
240
Jennifer D Lee
22
1,011
1
1
241
Sherwin J Singer
5
1,010
3
2
242
Paul A S Breslin
3
997
2
1
243
Thomas Burdyny
1
996
69
31
243
Edward H Sargent
1
996
70
31
245
Donna M Huryn
15
995
1
1
246
Simon Berritt
20
976
1
1
247
Hongseok Yun
13
966
1
1
248
Walther Mothes
8
963
2
3
249
David E Ash
10
937
1
1
250
Nicole Bellonzi
8
931
1
1
251
Bruno Melillo
23
928
1
1
252
Haolin Yin
18
922
1
1
253
P Peter Ghoroghchian
7
914
1
1
254
Peter D Kwong
6
910
9
19
255
Scott C Blanchard
7
904
4
3
256
Rudresh Acharya
3
902
2
3
257
Abraham Nitzan
25
887
2
5
258
Christophe Decroos
11
882
1
1
258
Thibault Cheisson
29
882
1
1
260
Mohammad R Imam
12
880
1
1
261
Fang Liu
13
872
1
1
262
Christopher J Wilson
3
871
1
1
263
Dong Su
7
866
19
25
265
Filippo Mangolini
2
860
5
2
266
Jianping Wang
9
856
7
2
267
Stephen G Dimagno
5
854
2
2
268
Omer Yaffe
6
853
2
2
269
Sen Zhang
8
844
4
4
270
Álvaro Gutiérrez-Bonet
8
841
1
1
271
Timothy V Duncan
14
839
1
1
272
Andrew J Lewis
16
837
1
1
273
Gary K Beauchamp
2
836
4
1
274
Hao-Jan Sun
9
835
2
2
275
Sami J Nummelin
3
832
4
3
276
Timothy M Swager
17
828
2
5
277
Roderic G Eckenhoff
24
825
3
3
278
Yang Hai
9
823
1
1
279
Yusen Qiao
19
820
1
1
280
James B Munro
4
819
4
2
281
David Cahen
4
814
8
4
282
Joel S Miller
4
811
9
4
283
Rienk van Grondelle
1
802
24
9
283
Gregory D Scholes
1
802
34
8
283
Govindjee Govindjee
1
802
25
4
283
Aaron J Mackey
1
802
1
1
287
Gary Hodes
3
800
2
2
288
Ju Li
4
795
26
26
289
Arvin Kakekhani
9
794
1
1
290
Russell Keast
1
778
7
2
291
Luiz Henrique Capparelli Mattoso
7
776
3
1
291
Nancy C Horton
2
776
3
1
293
Hans Wolfgang Spiess
11
773
2
3
294
Mark A Ratner
4
766
8
11
295
Patrick M Vora
1
758
9
2
296
Zhifei Yan
9
751
1
2
297
Donald H Berry
23
747
1
1
298
Zhixun Dou
2
746
4
7
298
Terje Johansen
2
746
26
845
298
Caiyue Xu
2
746
2
5
298
Rosa E Diaz
5
746
1
1
302
Ernesto Freire
12
745
3
7
303
Sharon Hammes-Schiffer
5
735
6
6
303
Nicholas J Porter
15
735
1
1
305
Maryna I Bodnarchuk
2
731
6
4
306
Vikas Nanda
5
729
9
3
307
Zheng Shi
9
727
1
1
308
Igor V Rubtsov
11
725
2
2
309
Robert Graf
12
721
1
3
310
Elizabeth Rhoades
24
712
2
2
311
Navid Madani
15
695
1
1
312
Quentin McAfee
4
694
2
2
313
Shaodong Zhang
6
690
2
1
314
Stephen J Klippenstein
16
689
3
6
315
Pramit K Chowdhury
12
688
3
1
317
Robert J Hickey
9
683
3
1
318
Michael R Gau
44
671
1
1
319
Yubo Qi
17
666
1
1
319
Peng Tan
3
666
3
1
321
Benjamin R Capraro
7
665
1
1
322
Annabelle Bertin
4
662
1
1
323
John D Mccoy
3
654
4
2
323
Acad Prof Kari Rissanen
1
654
56
11
325
Samuel M Levi
4
646
1
1
326
Ilya Levental
3
645
6
4
327
Joseph Francisco
23
633
3
4
328
Amber Jain
10
625
1
1
329
Mark H Hermanson
8
623
1
1
330
Young-Han Shin
8
620
4
2
331
Benjamin E Partridge
14
619
1
3
332
Robert A Riggleman
14
615
1
2
333
Wenjie Dou
23
613
1
1
334
Jun Wang
9
611
3
5
335
Nataliya Di Donato
2
608
12
13
335
Geert R Mortier
2
608
36
13
335
Katsuhiko Shirahige
2
608
13
9
335
Lauren J Francey
2
608
7
2
335
Michael B Petersen
2
608
9
1
340
Minyan Li
17
607
1
1
341
Nathan Z Koocher
4
606
2
1
342
Chen Zhu
5
603
1
1
343
Martin T Zanni
4
602
4
3
344
Matthew J Lamarche
7
601
1
1
345
Michael C Nicastri
5
600
1
1
347
Qi Xiao
12
596
1
1
348
Jason Gorman
2
595
11
14
349
Richard Friend
1
590
60
33
349
Young-Hoon Kim
1
590
14
5
349
Yong-Hee Lee
1
590
2
2
349
Henk Bolink
1
590
15
5
349
Bin Hu
1
590
17
4
349
Laura Martinez-Sarti
1
590
3
2
349
Jaehyeok Park
1
590
2
2
349
Gyeong-Su Park
1
590
7
3
349
Tae-Woo Lee
1
590
41
14
349
Jin-Woo Park
1
590
10
5
349
Young-Hoon Kim
1
590
6
4
349
Seunghyup Yoo
1
590
18
6
349
Aditya Sadhanala
1
590
23
14
349
Sungjin Kim
1
590
12
7
349
Hengxing Xu
1
590
3
3
365
Jonathan S Owen
2
589
7
4
366
Jerome R Robinson
15
588
1
1
367
Yingchao Chen
4
584
2
2
368
Dillon D Fong
2
583
12
4
368
Carol Thompson
2
583
5
3
368
Monica Ilies
7
583
1
1
371
Rebecca J Wiles
6
582
1
1
371
Weon-kyu Koh
7
582
1
1
371
Virginia M-Y Lee
13
582
4
11
374
Liang Qi
3
577
5
7
375
Sundaram Balasubramanian
8
576
1
2
375
B L Bhargava
6
576
1
1
377
John Mark Martirez
8
569
2
4
377
Soong Ju Oh
6
569
3
7
379
Jiadi Zhang
9
564
1
1
380
Matthew A Deardorff
3
559
13
8
381
Jessada Mahatthananchai
3
555
1
1
382
Ayyalusamy Ramamoorthy
6
553
6
8
383
Elena V Shevchenko
1
551
6
4
384
Vishikh Athavale
4
550
1
1
385
Michael A Lampson
10
548
4
6
386
Anjan Ray
7
545
2
3
387
Jing Luo
7
543
1
1
388
Marco De Vivo
5
537
1
2
389
Jeung Gon Kim
6
536
1
1
390
Xinjing Tang
9
527
1
1
391
Russell Devane
6
526
2
1
392
Sergei A Vinogradov
15
523
3
9
392
Maximilian F S J Menger
2
523
2
1
392
D Vale Cofer-Shabica
2
523
1
1
395
Yuezhi Mao
2
521
7
3
395
Derek C G Muir
3
521
16
9
397
Chunlai Chen
11
519
2
1
397
A T Charlie Johnson
14
519
2
3
399
Abel Carreras
1
518
5
3
399
Pavel Pokhilko
1
518
4
3
399
Tomasz A Wesolowski
1
518
7
15
399
Susi Lehtola
1
518
14
9
399
Katherine J Oosterbaan
1
518
4
2
399
James R Gayvert
1
518
2
2
399
Jeffrey B Neaton
1
518
37
20
399
Mario Hernández Vera
1
518
2
1
399
Sebastian Ehlert
1
518
23
18
399
Thomas Markovich
1
518
2
2
399
Sahil Gulania
1
518
2
2
399
Yu Zhang
1
518
13
6
399
Kevin Carter-Fenk
1
518
4
4
399
Daniel S Levine
1
518
5
4
399
Jeremy L Hitt
7
518
1
1
399
Marc P Coons
1
518
2
2
399
Jonathan Thirman
1
518
3
2
399
Qingguo Feng
1
518
6
2
399
Wojciech Skomorowski
1
518
7
2
399
Kevin J Koh
1
518
7
7
399
Josefine H Andersen
1
518
2
2
399
Kerwin Hui
1
518
2
2
399
Atsushi Yamada
1
518
6
3
399
Alexandre Tkatchenko
1
518
24
35
399
Yi-Pei Li
1
518
5
2
399
Hugh G A Burton
1
518
3
2
399
Ádám Jász
1
518
2
1
399
Hanjie Jiang
1
518
5
4
399
Dennis Barton
1
518
1
1
399
Alex J W Thom
1
518
11
5
399
Alan E Rask
1
518
2
2
399
Kuan-Yu Liu
1
518
3
3
399
Gábor János Tornai
1
518
1
1
399
Alan D Chien
1
518
2
2
399
Run R Li
1
518
2
2
399
Kaushik D Nanda
1
518
3
3
399
Alexander A Kunitsa
1
518
3
2
399
Matthias Loipersberger
1
518
6
3
399
Fabijan Pavošević
1
518
5
2
399
Triet S Nguyen
1
518
2
2
399
Alexander Zech
1
518
6
14
399
Sonia Coriani
1
518
27
27
399
Romit Chakraborty
1
518
3
2
399
Jan-Michael Mewes
1
518
2
2
399
Elliot C Rossomme
1
518
2
2
399
Bang Cong Huynh
1
518
1
1
399
Andreas Dreuw
1
518
13
15
399
Daniel Lefrancois
1
518
2
2
399
Srimukh Prasad Veccham
1
518
2
2
399
Maxim V Ivanov
1
518
4
3
399
Shirin Faraji
1
518
3
2
399
Adam Rettig
1
518
2
2
399
Stefanie A Mewes
1
518
4
13
399
Eloy Ramos-Cordoba
1
518
3
2
399
Zsuzsanna Benda
1
518
4
2
399
Jiashu Liang
1
518
2
2
399
Jonathon Witte
1
518
2
2
399
K Birgitta Whaley
1
518
19
13
399
Pierpaolo Morgante
1
518
5
4
399
Alexander C Paul
1
518
3
2
399
Cristina Elizabeth González-Espinoza
1
518
2
1
399
Saswata Dasgupta
1
518
4
2
399
Anastasia O Gunina
1
518
3
8
399
Bhaskar Rana
1
518
2
2
399
Marcus D Liebenthal
1
518
2
2
399
Sven Kähler
1
518
2
1
399
Qinghui Ge
1
518
3
2
399
Marc de Wergifosse
1
518
7
2
399
Norman M Tubman
1
518
3
3
399
Joonho Lee
1
518
6
5
399
Teresa Head-Gordon
1
518
23
11
399
Michael F Herbst
1
518
2
2
399
Zhen Tao
1
518
2
1
399
Maximilian Scheurer
1
518
16
9
399
Marta L Vidal
1
518
6
6
399
Felix Plasser
1
518
16
18
399
C William Mccurdy
1
518
5
3
399
A Eugene Deprince, Iii
1
518
15
13
399
Adrian L Dempwolff
1
518
3
1
399
Diptarka Hait
1
518
6
4
399
István Ladjánszki
1
518
3
2
399
Kun Yao
1
518
3
2
399
Christopher J Stein
1
518
15
15
399
Aaditya Manjanath
1
518
4
3
399
Ying Zhu
1
518
1
1
399
Tarek Scheele
1
518
1
1
399
Peter F Mclaughlin
1
518
1
1
399
Manuel Hodecker
1
518
1
1
399
Tim Stauch
1
518
5
2
399
Jie Liu
1
518
4
2
399
J Wayne Mullinax
1
518
3
3
399
Garrette Paran
1
518
1
1
399
Gergely Gidofalvi
1
518
7
7
399
Stefan Prager
1
518
1
1
494
Klaas Wynne
8
512
4
3
495
Aiwei Tian
6
511
1
1
496
Trond Lamark
1
510
116
839
496
Jiajun Zhu
1
510
7
7
496
Ji-An Pan
1
510
5
2
496
Wei-Xing Zong
1
510
135
845
496
Brian C Capell
1
510
4
5
496
Takeshi Shimi
1
510
8
3
496
Robert D Goldman
1
510
15
7
496
Andrey Ivanov
1
510
4
3
496
Stephen A Adam
1
510
9
5
505
Pravas Deria
10
509
4
4
505
Constantinos C Stoumpos
2
509
18
14
505
Mercouri G Kanatzidis
2
509
41
33
508
Suzanne C Bart
12
508
2
3
509
Cong Wang
9
507
1
1
510
Roseanne J Sension
5
505
4
2
510
Francesca M Marassi
3
505
3
3
512
Daniel B Straus
7
498
2
1
513
Heinrich Roder
4
490
2
2
514
Yinsheng Guo
1
489
5
4
514
Marcos A Pimenta
1
489
23
17
514
Louis E Brus
1
489
11
12
514
Tony F Heinz
2
489
22
35
514
Chen Chen
7
489
1
1
519
Erwan Watrin
1
488
2
1
519
Elfride De Baere
1
488
58
14
519
Takehiko Itoh
1
488
17
7
519
Ryuichiro Nakato
1
488
6
1
519
Hiroyuki Seimiya
1
488
7
1
524
Tao E Li
17
487
1
1
525
David Ceperley
2
486
4
2
526
Benjamin A Garcia
8
483
11
46
527
Chanat Aonbangkhen
7
480
1
1
528
Aaron T Fafarman
4
479
2
3
529
Xiao-Dong Yang
14
472
1
1
530
Celina García
7
470
1
1
531
Mu-Hyun Baik
14
468
2
6
532
Jérémie Prévost
12
466
2
2
533
Brandon A Vara
4
462
1
1
534
Erdinc Sezgin
1
461
12
1
534
Petra Schwille
1
461
19
6
534
Stuart A Rice
5
461
14
8
537
Javad Amani
8
459
1
1
538
John J Ferrie
19
454
1
1
539
Paul H Axelsen
10
453
2
2
540
Dipankar Sahoo
11
450
1
1
541
Valentino R Cooper
6
449
4
14
541
Juthanat Kaeobamrung
2
449
1
1
541
Bernd Ensing
3
449
1
1
544
Arpad Z Szarka
4
447
1
1
545
Kenichi Kuroda
1
446
11
4
545
Trevor M Penning
9
446
4
5
545
Marzena Pazgier
12
446
3
3
548
Lívia N Cavalcanti
5
444
1
1
549
Dennis R Burton
1
439
35
32
549
Peter J Rossky
3
439
4
3
549
Matthias M Waegele
5
439
2
2
549
Samuel I Stupp
3
439
15
12
549
Sharon C Glotzer
5
439
5
5
549
Mark E Thompson
3
439
14
12
549
Zhou Zhou
1
439
7
3
556
A Paul Alivisatos
2
438
24
17
557
Tian Qiu
9
435
1
1
558
Craig Murray
13
433
2
1
558
Seung-gu Kang
6
433
1
1
558
Jens Glaser
4
433
6
4
561
Daeyeon Lee
8
432
6
7
561
Alexander A Baykov
9
432
2
2
564
Tianyi Liu
8
426
1
1
565
Daniel E Kaufmann
6
425
2
2
566
Zhengtang Luo
5
424
8
5
567
Maria Ribagorda Lobera
4
423
3
1
568
Tiezheng Jia
9
422
1
1
568
Neil Shenvi
3
422
3
1
570
Ming-Ming Zhou
1
419
5
4
571
Jeremy D Osko
14
418
1
1
572
Joel S Bader
1
417
34
14
573
Chi-How Peng
7
416
2
1
574
Cecilia Anaya De Parrodi
5
414
1
1
574
Arne Schon
7
414
2
5
576
Yike Zou
19
412
1
1
577
Mauro Ferrario
3
411
5
3
577
Sara E Mason
5
411
3
2
577
Christopher M Macdermaid
6
411
1
1
580
Idris Karakaya
3
409
3
1
580
Terry F Bidleman
1
409
13
6
580
Keith A Nelson
3
409
11
12
580
Yueh-Lin Loo
3
409
10
28
580
Hayley Hung
1
409
8
2
580
Keith Solomon
1
409
2
1
587
Zachary T Graber
4
408
1
1
588
Chong Fang
4
407
4
5
589
Jose Manuel Perez-Aguilar
12
406
1
3
590
Yujing Li
1
404
15
10
590
Yu Huang
1
404
52
38
590
Lingyan L Ruan
1
404
4
3
590
Chin-Yi Chiu
1
404
6
3
595
Rebecca F Wissner
8
403
1
1
596
Alessandro Senes
1
402
5
3
597
Yanfei Wang
12
400
1
1
598
Mounir Tarek
7
397
2
4
599
Ana Paula Valente
3
396
2
1
600
Balazs Pinter
15
394
1
1
600
Craig Streu
6
394
1
1
602
Michael Engel
2
392
6
5
603
Gregory V Hartland
11
391
3
9
604
Hidetoshi Kono
7
388
1
1
605
Takashi Kurogi
22
387
1
1
606
Smita Mukherjee
6
386
1
1
607
Joseph R Ecker
1
385
41
66
607
Jose M Alonso
1
385
14
15
607
Takashi HIRAYAMA
1
385
7
3
607
Joseph J Kieber
1
385
6
6
611
Beatrice H Hahn
8
384
14
51
612
Jaehoon Sim
3
383
5
1
613
Ahmad Arabi Shamsabadi
13
382
2
5
614
Ayanjeet Ghosh
8
380
1
1
614
Joseph W Strzalka
18
380
1
10
616
Conor M Haney
11
379
1
1
616
Neil C Tomson
19
379
1
1
618
David S Ginley
2
378
10
5
619
Giacomo Fiorin
5
377
1
3
619
Lauren N Grant
14
377
1
1
621
Koen Clays
6
376
6
5
622
Xuefeng Guo
2
375
19
10
622
Chunhui Gu
2
375
3
2
622
Hillel Haim
5
375
2
1
622
Jianxin Guan
2
375
3
2
626
Julianne C Griepenburg
5
373
1
1
627
David B Mitzi
1
372
23
12
627
Seth R Marder
1
372
53
27
627
Michael F Toney
1
372
69
27
627
Hirokazu Arimoto
2
372
9
1.1K
627
Antoine Kahn
1
372
17
11
627
Boris Rybtchinski
1
372
5
3
627
Vladan Stevanović
1
372
7
3
627
Qi Ou
8
372
2
4
627
Yitzhak Mastai
1
372
8
2
627
Michael F Toney
1
372
81
40
627
Yaron Paz
1
372
4
2
627
David Zitoun
1
372
7
3
627
Joseph Berry
1
372
32
29
627
Tonio Buonassisi
1
372
22
11
641
Diomedes Saldana-Greco
7
370
1
1
641
Victoria P Barber
8
370
1
1
643
Samuel E Sherman
6
369
1
2
644
Burkhard Bechinger
1
367
2
1
644
Bruce D Hammock
3
367
45
12
646
Stanley J Opella
2
366
4
3
647
Anoop R Damodaran
5
363
4
4
647
Daniel G Kuroda
11
363
2
2
649
Anne B Mccoy
8
362
4
6
649
Jeroen K Vermunt
1
362
9
2
651
Matteo Monai
4
360
2
2
652
Nisalak Trongsiriwat
10
359
1
1
653
Xuefeng Fu
9
357
2
2
654
Shiyu Du
3
356
9
9
654
Qing Huang
3
356
16
12
654
Neha P Kamat
3
356
4
2
657
Davit Jishkariani
12
355
1
1
658
Vladimir M Fridkin
2
353
4
3
659
Yaoting Wu
10
352
1
1
659
Ileana M Pazos
6
352
1
1
661
Younghoon Kim
1
351
2
2
662
Antonino Marco Saitta
7
350
2
1
663
Jordan S Compton
3
349
1
1
663
Hang Yin
3
349
12
82
665
Won-Suk Kim
7
348
3
2
666
Zongquan Gu
2
346
3
2
666
Rani Ojha
3
346
4
652
668
Chang-Beom Eom
1
344
51
28
669
Michael F Vansco
13
342
1
1
670
Chang Liu
3
341
4
3
670
Rauful Alam
6
341
2
2
672
Youn K Kang
7
340
2
1
672
I-Wei Chen
1
340
13
6
674
Yuping Wang
2
339
37
13
674
J Fraser Stoddart
2
339
52
27
676
James H Eberwine
6
338
4
20
677
Bertrand Donnio
9
337
2
2
677
Hyunil Jo
10
337
1
1
677
Carol M Taylor
1
337
6
1
677
Joseph W Bennett
10
337
2
2
677
Tianshuo Zhao
5
337
2
2
682
Christopher S Waldron
1
336
2
2
682
Robert Carpick
6
336
5
11
682
David Haddleton
1
336
22
5
682
Athina Anastasaki
1
336
8
3
682
Jiahao Zhang
3
336
1
1
682
Paul Wilson
1
336
6
2
682
Alice J Haddleton
1
336
4
2
682
Qiang Zhang
1
336
4
4
682
Ronan Mchale
1
336
11
2
691
Andrew L Bennett-Jackson
1
335
3
2
691
Alessia Polemi
1
335
7
2
691
Dominic Imbrenda
1
335
4
2
691
Geoffrey Xiao
1
335
4
2
695
Alexander V Zabula
9
334
4
3
696
Steven R Wisniewski
9
331
2
2
696
Michele Parrinello
2
331
10
9
696
Michael W Fennie
7
331
1
1
699
Matthew R Suchomel
2
329
4
3
700
Yu Li
1
327
6
3
700
Na Xin
1
327
12
7
702
Peter M Iovine
4
326
2
2
703
Viktor C Polites
5
325
1
1
703
Bo Qu
9
325
1
1
703
Gang Zheng
7
325
5
12
706
James J-W Duan
7
324
1
1
706
Jeff Owrutsky
3
324
5
3
706
Yi Fang
7
324
1
1
709
Cynthia I Chude
2
323
2
2
709
Amruta Ronghe
2
323
3
1
712
Kimberly C Mullane
9
322
1
1
713
Lu Lu
3
321
1
1
714
Ryan Dykstra
3
319
2
2
715
Noel N Kim
3
317
3
2
715
Abdulmaged M Traish
3
317
5
2
717
Jyo Lyn Hor
3
315
2
2
718
Dong Qin
9
313
3
9
718
Yu-Hsiu Wang
6
313
2
3
718
Everaldo Carlos Venâncio
6
313
1
1
721
William P Dailey
15
311
1
1
722
Rudolf K Allemann
6
310
4
4
722
Qiaomu Yang
8
310
1
1
722
Heng Gao
4
310
3
2
722
Yue Zhang
8
310
1
1
722
James O Jensen
5
310
1
1
727
Akihiro Sugawara 菅原章公
4
309
3
1
728
Daniel S Terry
3
308
4
8
729
Alyssa S Haynes
1
307
2
1
729
Katelyn Billings
2
307
1
1
731
Kevin T Turner
6
305
4
4
732
Jonathan Richard
4
303
2
2
733
Alex N Bullock
2
301
4
2
734
Alexandra Boltasseva
2
300
20
13
734
Edward R Ballister
3
300
2
2
736
D Miklos Szantai-Kis
9
299
1
1
736
One-Sun Lee
6
299
2
2
738
Jeffrey M Mcneill
5
295
1
1
738
Nicholas A Piro
3
295
6
4
740
Corwin H Booth
8
294
4
3
741
Daniel J Magagnosc
2
293
3
2
741
Andrea J Liu
2
293
10
13
741
Daniel S Gianola
2
293
4
3
744
Richard A Loomis
6
291
2
1
744
Masoud Soroush
17
291
2
6
746
Yinghua Jin
1
290
16
7
747
Barbara Marchetti
7
288
2
2
748
Donald A Tomalia
4
285
1
1
748
William M Wuest
6
285
4
6
750
Barton F Haynes
5
283
13
28
751
William David Tolbert
7
282
3
2
751
Hongwei Li
6
282
2
1
751
Jian Lu
1
282
7
3
751
Edoardo Baldini
1
282
10
3
751
Jeff Rawson
8
282
2
4
751
Xian Li
1
282
4
3
751
Meng Li
2
282
4
3
758
Oleg V Kulikov
2
280
4
1
759
Dahlia Klein
3
279
2
7
759
Lisa Marie Kammer
4
279
1
1
761
Wenbin Li
1
278
6
5
761
Gregory A Caputo
2
278
7
7
763
Robert J Doerksen
4
277
4
4
764
Emanuele Marino
9
276
1
1
764
Joomyung V Jun
6
276
1
1
766
Tatiana V Esipova
4
275
3
6
766
Han Wang
3
275
2
2
766
Karsten Meyer
12
275
4
12
766
Christopher R Walters
7
275
1
1
766
Gang Hee Han
2
275
5
7
771
Rustem I Litvinov
2
273
13
12
771
Joel S Bennett
3
273
6
5
773
María Jesús Cabrera-Afonso
6
272
1
1
773
Cheng-Te Lin
2
272
36
27
773
Jérôme Hénin
4
272
1
3
776
Jai-Yoon Sul
3
271
4
3
776
Bryan W Berger
1
271
10
3
776
Hang Yin
2
271
8
6
776
Hanlin Yin
1
271
3
1
776
Joanna S G Slusky
1
271
4
1
776
B Scott Freeze
7
271
1
1
782
David K Kim
3
270
3
2
784
Sheldon Park
7
269
2
2
784
Anatoliy V Popov
7
269
4
4
786
Julian Gebhardt
10
268
1
1
786
Minh H Nguyen
9
268
1
1
788
Laura Gagliardi
4
267
18
62
789
Shuai Zheng
7
266
1
1
789
Pierrik Lassalas
3
266
1
1
791
Mirna El Khatib
7
264
2
1
792
Arijitt Borthakur
5
263
4
4
793
Eric U Borguet
9
262
3
7
794
René Roy
1
261
18
7
794
Michelle R Bunagan
6
261
1
1
796
Joe Swift
4
260
1
1
797
Alberto Tiraferri
4
258
6
10
797
Mostafa Dadashi Firouzjaei
4
258
5
7
797
Mohtada Sadrzadeh
4
258
4
3
797
Yale E Goldman
10
258
3
3
797
Matteo Dal Peraro
4
258
4
5
797
Mark A Elliott
4
258
4
5
797
Balogh, Dt
1
258
3
1
797
Zhaoxia Qian
7
258
1
1
797
Ehsan Zolghadr
4
258
3
3
806
Mingbin Yuan
2
257
2
2
807
Olena Taratula
5
256
2
2
808
Adam E Cohen
1
254
8
9
808
Howard A Stone
1
254
39
20
808
Yuming Lai
3
254
2
2
811
Gregory K Friestad
4
253
3
3
812
Yen Wei
1
252
34
19
812
Yijie Jiang
2
252
4
3
812
Peibiao Zhang
1
252
6
4
812
Xuesi Chen
1
252
37
30
816
Andrew J Peat
1
250
2
2
816
Lijun Fan
1
250
1
1
816
Maxime Veillette
3
250
2
2
819
Na Sai
1
249
7
3
820
Hui Jiang
6
248
2
4
820
Renyu Liu
12
248
4
5
820
Yitao Zhang
7
248
1
1
823
Andrew D Dillon
1
247
3
3
823
Subham Dastidar
1
247
3
2
825
Nairiti J Sinha
9
246
1
1
826
Mengbin Chen
6
245
1
2
827
Matthew A Kellett
2
244
1
1
828
Jaehee Lee
2
243
3
3
829
Qianfan Zhang
1
242
27
13
829
Zhong-Heng Fu
1
242
4
4
829
Dominik Legut
1
242
26
7
829
Chen Si
1
242
6
3
829
Timothy C Germann
1
242
10
8
829
Ning Wang
1
242
3
2
829
Ruifeng Zhang
1
242
16
7
837
Nickolas H Anderson
3
241
3
3
838
Galen T Craven
11
237
1
2
839
Vemika Chandra
1
236
3
3
839
Wei Tong
1
236
23
9
839
Peter D Adams
1
236
2
10
839
Christopher James Kloxin
8
236
3
9
839
Melanie Ott
1
236
21
33
839
Parinaz Fozouni
1
236
7
10
839
Lu Wang
1
236
6
7
839
Bren E Cole
10
236
1
1
847
Tae Kyung Kim
1
235
8
4
847
Alexandra V Ulyanova
1
235
4
3
847
John A Wolf
1
235
10
10
847
Junhyong Kim
1
235
18
16
847
James W Leahy
5
235
3
2
847
Trung Cao
2
235
1
1
847
M Sean Grady
1
235
8
4
854
Ji-Hyuk Choi
1
234
5
3
855
David N Beratan
7
233
7
9
856
Ciril Jimeno
4
232
1
1
856
Beatriz Pacheco
3
232
1
1
858
Robert Lovrincic
1
231
10
5
858
Thomas Kirchartz
1
231
20
16
858
Mark Goulian
5
231
4
10
858
Achintya Bera
1
231
2
2
862
Hanqin Liu
4
230
4
3
862
Craig C Martens
5
230
3
4
862
Dong-Kyun Ko
1
230
7
3
865
Kevin M Jude
4
229
1
10
866
Vincenzo Carnevale
5
228
4
6
866
Mingliang Zhang
7
228
2
2
868
Ruijuan Xu
2
227
6
4
868
Jungyeob Ham
3
227
1
1
870
Daniel Sebastiani
2
226
2
1
871
David G Huntsman
2
225
94
149
872
Geraint H M Davies
8
224
1
1
872
Haonan Wang
8
224
1
1
872
Jiacen Guo
9
224
1
2
875
Grace Brannigan
4
223
3
3
875
Jorge Fj Coelho
6
223
4
7
875
Maria H Gil
6
223
4
3
875
Jorge F J Coelho
6
223
4
6
875
Yibing Wu
4
223
2
10
880
Wei Wang
2
221
5
5
881
Nicholas J Greybush
5
220
2
2
881
Wenkai Zhang
5
220
3
6
881
Cristian Staii
2
220
8
4
881
Benjamin W Roose
12
220
1
1
885
Kalyan Das
2
219
10
7
885
Eddy Arnold
2
219
5
6
887
Komlavi Dzidula Koshigan
1
218
1
1
887
Anindita Basu
1
218
4
4
887
Robert Ivancic
1
218
2
2
887
Zoey S Davidson
1
218
4
5
887
Paulo E Arratia
1
218
10
4
887
Carlos Ortiz
1
218
2
2
887
Daniel Strickland
1
218
1
1
887
Julien Fontaine
1
218
5
3
887
Ekin Cubuk
1
218
7
8
887
Nathan C Keim
1
218
7
3
887
Samuel S Schoenholz
1
218
6
6
887
Douglas J Durian
1
218
9
13
887
Joel A Lefever
1
218
4
3
887
Yun-Ru Huang
1
218
4
3
887
Douglas J Jerolmack
1
218
5
3
887
Reuben J. Peters
2
218
6
22
887
Arjun G Yodh
1
218
45
22
887
Soumik Biswas
4
218
1
2
905
Lukasz Bugaj
1
217
5
3
905
Young Jun Oh
1
217
9
2
905
Gautam Sikka
1
217
5
2
905
Daniel Nyhan
1
217
6
2
905
Kevin G Soucy
1
217
3
1
910
Kevin Burgess
3
215
7
5
910
Inge Asselberghs
3
215
7
10
910
Huolin L Xin
2
215
35
47
910
Carlos F Lopez
4
215
2
2
914
Mei Hong
2
214
7
6
914
Iman Doostan
1
214
2
2
914
Nuhad K Ibrahim
1
214
12
9
914
Min Yi
1
214
9
4
914
Meghan S Karuturi
1
214
7
2
914
Katherine C Elbert
11
214
1
4
914
Kelly K Hunt
1
214
21
11
914
Khandan Keyomarsi
1
214
8
6
914
Yang Zhao
1
214
1
1
914
Akshara Singareeka Raghavendra
1
214
7
2
914
Smruthi Vijayaraghavan
1
214
2
2
914
Melissa Birol
5
214
1
1
914
Jean-Nicolas Desrosiers
5
214
1
1
914
David J Miller
3
214
2
2
914
Debasish Tripathy
1
214
27
14
914
Yang Zhao
1
214
5
4
930
Young Do Kwon
3
211
2
13
930
David T Anderson
9
211
2
2
932
Yi Jin
9
210
1
1
933
Alex Mcskimming
6
209
2
2
934
Finn K Hansen
4
208
4
2
934
Nicholas A Kotov
3
208
19
91
934
Timothy A Cross
4
208
8
8
934
Richard J Karpowicz Jr
3
208
1
1
938
Katherine W Pulsipher
9
207
1
1
938
Samuel O Odoh
2
207
5
6
938
Brian Space
7
207
4
19
938
Keith Searles
6
207
2
3
942
Jing Li
2
206
20
24
942
Sunbin Deng
9
206
1
1
942
Yu Tian
5
206
1
2
945
Stosh A Kozimor
5
205
6
5
946
Maolin Lu
3
204
3
4
946
Nelu Grinberg
5
204
1
1
948
J Ilja Siepmann
4
203
5
10
949
Jizhou Yan
1
202
5
2
949
Patricia Ernst
1
202
7
5
949
Tolga N V Karsili
6
202
5
5
949
Steven D Hudson
2
202
6
5
949
Hui Zhang
1
202
1
1
954
Stephen A Shinsky
5
201
2
2
955
Satoshi Uchida
1
200
2
1
955
Satoshi Uchida
1
200
3
1
957
Wu Liu
1
199
7
2
957
Fernando Soto
1
199
3
3
957
Laszlo Kurti
6
199
6
6
957
Joseph Wang
1
199
23
18
957
Nitesh Nama
1
199
3
2
957
Liqiang Ren
1
199
5
7
963
Min-Hao Kuo
1
198
5
7
963
John M Denu
1
198
18
22
963
Donita C Brady
2
198
2
17
963
Jeffrey M Axten
3
198
1
4
963
Raymond C Trievel
1
198
8
6
968
Lena F Kourkoutis
2
196
19
36
968
Héctor Abruña
2
196
10
16
968
Jun Yi
2
196
4
2
968
Yong Ho Kim
1
196
3
1
968
Hsing-Ta Chen
14
196
1
1
968
Gianni Cardini
3
196
1
1
968
James C Hone
1
196
83
67
968
Yong Ho Kim
1
196
5
2
968
Yao Yang
2
196
8
9
968
Aaron M Lindenberg
2
196
12
10
968
Gevorg Grigoryan
1
196
5
9
968
J M Vohs
1
196
3
3
968
Marcus Freitag
1
196
3
3
981
Georgia Potsi
1
195
7
2
981
Xin Huang
1
195
9
6
981
Tomás A Arias
1
195
6
6
981
Emmanuel P Giannelis
1
195
10
13
981
Hongsen Wang
1
195
4
4
981
Alexander V Soudackov
1
195
5
4
981
Baran Eren
1
195
7
6
981
Qihao Li
1
195
3
3
981
Xinyao Lu
1
195
4
4
981
Miquel B Salmerón
1
195
19
16
981
Andrej Singer
1
195
7
8
981
Geoffrey W Coates
1
195
15
13
981
Jin Suntivich
1
195
8
21
981
Ellen A Murray
1
195
6
5
981
Pengtao Xu
1
195
7
4
981
Enrique Herrero
1
195
10
4
981
Manos Mavrikakis
1
195
30
29
981
Lin Zhuang
1
195
20
25
981
Cheng He
1
195
5
6
981
Li Xiao
1
195
8
13
site/software ©
exaly
; All materials licenced under
CC by-SA
.