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exaly
›
Journals
›
Journal of Chemical Theory and Computation
›
top-authors
›
articles
Journal of Chemical Theory and Computation
5.8
(top 5%)
impact factor
9.8K
(top 2%)
papers
504.6K
(top 1%)
citations
249
(top 1%)
h
-index
5.9
(top 5%)
extended IF
11.1K
all documents
548.8K
doc citations
477
(top 1%)
g
-index
Top Authors (by articles)
#
Name
Articles
Citations
R ARank
R CRank
1
Vicenzo Barone
8
276
1
1
1
Christian Ochsenfeld
8
314
1
2
3
Donald G Truhlar
7
279
1
4
4
Markus Reiher
6
440
1
2
5
Giovanni Scalmani
5
263
1
1
5
Jacob Kongsted
5
101
1
1
7
Chao Yang
4
166
1
2
7
Emily Ann Carter
4
82
1
6
7
Jógvan Magnus Haugaard Olsen
4
90
1
1
7
Garnet Chan
4
501
1
1
7
Alexander D Mackerell
4
289
1
2
7
Alberto Baiardi
4
143
1
1
7
Gregory A Voth
4
147
2
4
7
Martin Head-Gordon
4
217
2
3
7
Jörg Kussmann
4
157
1
1
7
Benoı̂t Roux
4
464
1
1
7
Andreas Dreuw
4
143
1
1
7
Sandeep Sharma
4
582
1
1
7
Christophe Chipot
4
320
1
1
7
Henry F Schaefer
4
1.2K
1
1
7
Frank Neese
4
747
3
1
22
Leticia Gonzalez
3
131
2
4
22
Qiang Shao
3
43
1
1
22
Jean-Philip Piquemal
3
163
1
1
22
Jan Řezáč
3
202
1
1
22
Lin Lin
3
152
1
2
22
Xiaosong Li
3
131
1
2
22
Gerhard Hummer
3
191
1
2
22
Wei Li
3
169
1
1
22
Hannes Jónsson
3
107
3
3
22
Roi Baer
3
171
1
1
22
Mario Barbatti
3
414
1
1
22
Jochen Autschbach
3
67
1
6
22
Thomas A Niehaus
3
480
1
1
22
Wei Hu
3
152
1
3
22
Michal Otyepka
3
158
1
4
22
Richard A Friesner
3
309
1
1
22
Edward G Hohenstein
3
1.2K
1
1
22
Denis Jacquemin
3
164
2
2
22
David Dubbeldam
3
117
1
1
22
Benedetta Mennucci
3
168
1
2
22
Eric Neuscamman
3
74
1
1
22
Todd J Martinez
3
171
2
4
22
David A Dixon
3
148
3
2
22
Junwei Lucas Bao
3
125
1
5
22
C David Sherrill
3
1.2K
1
1
22
Nicolas Ferré
3
58
1
1
22
Pengyu Ren
3
119
1
2
22
Casper Steinmann
3
47
1
1
22
Erin Johnson
3
138
1
2
22
Sandra Luber
3
61
1
2
22
Francesco A Evangelista
3
1.2K
1
1
22
Peter V Coveney
3
216
1
1
22
Chris -Kriton Skylaris
3
52
1
5
22
Felix Plasser
3
120
1
1
22
Mihaly Kallay
3
123
1
2
22
Luigi Genovese
3
131
1
1
22
Jonathan W Essex
3
194
1
1
22
Piero Procacci
3
71
1
1
22
Vijay S Pande
3
229
2
4
22
Adrian H Elcock
3
114
1
1
22
Daniel Neuhauser
3
171
1
1
22
Franco Egidi
3
164
1
1
22
Riccardo Chelli
3
71
1
1
22
Justin M Turney
3
1.2K
1
1
22
Gunnar Schmitz
3
67
1
1
22
Daniele Licari
3
124
1
1
68
Martin Zacharias
2
30
2
7
68
Laura Gagliardi
2
72
7
11
68
Pavel Hobza
2
82
2
2
68
Adam S Foster
2
18
1
7
68
Florian Libisch
2
40
1
2
68
Gábor I Csonka
2
98
1
1
68
Alan E Mark
2
69
1
1
68
Barira Islam
2
100
1
2
68
Scott Habershon
2
68
1
1
68
Alexander A Auer
2
651
1
1
68
Kai Leonhard
2
94
1
1
68
Karol Kowalski
2
80
1
1
68
Max Schwilk
2
272
1
1
68
Michele Parrinello
2
105
3
4
68
Justin A Lemkul
2
166
1
1
68
Martial Boggio-Pasqua
2
85
1
1
68
Wei-Liang Zhu
2
37
2
4
68
Joachim Dzubiella
2
40
1
6
68
Shu-Hua Li
2
71
1
3
68
Walter Thiel
2
380
4
1
68
Kim Baldridge
2
21
1
5
68
Shunzhou Wan
2
189
1
1
68
Klaus Schulten
2
211
1
1
68
Monica Vasiliu
2
121
2
2
68
Frederick R Manby
2
58
1
1
68
Ulf Ryde
2
141
1
1
68
Steven E Wheeler
2
55
1
2
68
Marco Caricato
2
36
1
3
68
Tim Clark
2
32
3
10
68
Stefano Caprasecca
2
119
1
1
68
Gerrit Groenhof
2
192
1
1
68
Raimondas Galvelis
2
78
1
1
68
Karsten Reuter
2
59
2
8
68
Joseph A Morrone
2
133
1
1
68
Holger Gohlke
2
54
1
4
68
Brian K Radak
2
187
1
1
68
Bin Chen
2
29
1
1
68
Yury Minenkov
2
125
1
1
68
Georg Kresse
2
157
2
2
68
Kuang Yu
2
40
1
1
68
Giovanni Bussi
2
72
1
3
68
YIhan Shao
2
53
1
2
68
Heather J Kulik
2
139
2
3
68
Michael Feig
2
43
1
4
68
Angela K Wilson
2
64
1
2
68
Dmitry I Sharapa
2
32
1
2
68
Andrew M Teale
2
80
1
1
68
Shiwei Zhang
2
82
2
4
68
Mark S Miller
2
91
1
1
68
Yuji Sugita
2
78
3
3
68
Stefan Knecht
2
180
1
1
68
Bun Chan
2
68
1
2
68
Jianing Li
2
43
1
3
68
Christoph Riplinger
2
120
1
2
68
Xavier Blase
2
108
1
2
68
Hans-Joachim Werner
2
272
1
1
68
Nicholas P Brawand
2
79
1
2
68
Ali Alavi
2
359
1
1
68
Zhendong Li
2
106
1
1
68
Ignacio Fdez Galván
2
37
1
3
68
Piotr Setny
2
15
1
2
68
Andreas Köhn
2
134
1
1
68
Toru Shiozaki
2
259
1
1
68
Sheng Guo
2
120
1
3
68
Juha Vaara
2
38
1
1
68
Luigi Cavallo
2
125
5
8
68
Christine Peter
2
88
1
1
68
Oliviero Andreussi
2
134
1
1
68
Thomas F Miller Iii
2
58
1
2
68
Masaaki Saitow
2
1.2K
1
1
68
Gregory J O Beran
2
53
1
1
68
Ken A Dill
2
133
1
3
68
Robert M Parrish
2
1.2K
1
1
68
Richard W Pastor
2
78
1
3
68
Leonardo Guidoni
2
22
1
2
68
Benjamin G Janesko
2
38
1
2
68
Hui Li
2
68
1
1
68
Maria Belen Oviedo
2
141
1
1
68
Yasuteru Shigeta
2
59
2
2
68
Xiao-Gen Xiong
2
75
1
1
68
Marcus Elstner
2
99
1
1
68
Victor S Batista
2
175
5
6
68
Michael Gilson
2
117
1
2
68
Bryan M Wong
2
141
1
2
68
David J Wales
2
41
4
8
68
Bernard R Brooks
2
144
1
2
68
Gino A Dilabio
2
42
1
1
68
Jakob S Kottmann
2
31
1
1
68
Xiao He
2
87
1
3
68
Lina J Nåbo
2
49
1
1
68
Jae Woo Park
2
259
1
1
68
David d L Minh
2
40
1
1
68
(null)
2
118
1
1
68
Christine Isborn
2
84
1
1
68
Filippo Lipparini
2
104
1
1
68
Shuming Bai
2
357
1
1
68
Nese Kurt-Yilmaz
2
58
1
2
68
alberto Perez
2
133
1
1
68
Thomas Simonson
2
27
1
2
68
David W Wright
2
149
1
1
68
Lukas S Stelzl
2
127
1
1
68
Petr Stadlbauer
2
100
1
2
68
Emanuele Maggio
2
157
1
1
68
Tommaso Giovannini
2
118
1
1
68
Hans Lischka
2
53
2
1
68
Thomas Körzdörfer
2
33
1
1
68
Christof Hattig
2
60
1
1
68
Andrew C Simmonett
2
1.2K
1
2
68
Ulrich Kleinekathöfer
2
59
3
4
68
Imre Bakó
2
36
1
1
68
Ray Luo
2
38
1
3
68
Wen-Sheng Cai
2
109
1
1
68
Pal D Mezei
2
98
1
1
68
Gerald Knizia
2
246
1
1
68
Timothy Gould
2
44
1
2
68
Louis Lagardère
2
136
1
1
68
Gianni Cardini
2
28
1
1
68
Maria J. Ramos
2
46
1
5
68
Cristina García-Iriepa
2
33
1
5
68
Florian Andreas Bischoff
2
31
1
2
68
Niel M Henriksen
2
117
1
1
68
István Mayer
2
36
1
1
68
T Daniel Crawford
2
1.2K
1
1
68
Giulia Galli
2
79
3
6
68
Lingle Wang
2
174
1
3
68
Leon Freitag
2
151
1
1
68
Martti J Puska
2
178
1
2
68
Craig P Plaisance
2
98
1
2
68
Syed Awais Rouf
2
38
1
1
68
Adam Grofe
2
68
1
1
68
Anton V Sinitskiy
2
41
1
1
68
James T Kindt
2
24
1
1
68
ali Poursaeidesfahani
2
101
1
1
68
Alfredo Pasquarello
2
39
1
3
68
Darrin M York
2
130
1
1
68
Rommie E Amaro
2
246
1
1
68
Laurence E Fried
2
103
1
1
68
Ines Corral
2
84
1
1
68
Martin Stroet
2
69
1
1
68
Teresa Head-Gordon
2
55
1
6
68
Jiali Gao
2
68
1
1
68
Marco Pagliai
2
28
1
2
68
Leif C Kröger
2
94
1
1
68
Qiming Sun
2
395
1
1
68
Michiel Jan van Setten
2
114
1
2
68
Fabien Bruneval
2
46
1
2
68
Haohao Fu
2
109
1
1
68
Marton Voros
2
79
1
2
68
Celestino Angeli
2
111
1
1
68
Nicola Tasinato
2
104
1
1
68
Eran Rabani
2
124
1
1
68
Francesc Illas Riera
2
121
3
5
68
Tai-Sung Lee
2
130
1
1
68
Jesus Gonzalez-Vazquez
2
84
1
1
68
Veronique Van Speybroeck
2
125
2
5
68
Celia A Schiffer
2
58
1
4
68
Stephan Mohr
2
46
1
2
68
J Ilja Siepmann
2
44
1
5
68
David B Williams-Young
2
42
1
2
68
Gabriele Raabe
2
83
2
1
68
Diego Sampedro
2
33
1
4
68
Lori A Burns
2
1.2K
1
1
68
Robert Abel
2
174
1
2
68
Victor V Volkov
2
28
1
1
68
Nir Goldman
2
103
1
1
68
Thijs J H Vlugt
2
101
2
2
68
Ze-xing Qu
2
68
1
1
68
Takeshi Yanai
2
75
1
1
68
Julien Bloino
2
71
1
1
68
Dominika Zgid
2
57
1
3
68
Olga Lopez-Acevedo
2
70
1
1
68
Agastya P Bhati
2
189
1
1
68
Ivan Duchemin
2
108
1
2
68
Ping Yang
2
58
1
2
68
Jacek Dziedzic
2
44
1
1
68
Kirk A Peterson
2
121
2
2
68
Angel Rubio
2
233
3
4
68
Dage Sundholm
2
23
2
6
68
Adam A Holmes
2
462
1
1
68
Pedro A Fernandes
2
46
1
5
68
Feizhi Ding
2
58
1
2
68
Yujie Wu
2
174
1
1
250
Florian Weigend
1
226
3
1
250
Mohammad M Sultan
1
169
1
2
250
Andrew M James
1
1.1K
1
1
250
Ashutosh Kumar
1
1.1K
1
1
250
Jeffrey J Gray
1
1.4K
1
1
250
O Anatole Von Lilienfeld
1
532
2
1
250
Rhiju Das
1
1.4K
2
1
250
Roland L Dunbrack
1
1.4K
2
1
250
Wei Jiang
1
174
1
1
250
David Baker
1
1.4K
6
1
250
Elvira R Sayfutyarova
1
181
1
1
250
Daniel G A Smith
1
1.1K
1
1
250
Michael S Pacella
1
1.4K
1
1
250
Carmay Lim
1
501
1
1
250
Edward F Valeev
1
1.1K
2
1
250
Philip Bradley
1
1.4K
1
1
250
Panagiotis E Theodorakis
1
200
1
1
250
Michael Ruggenthaler
1
166
1
2
250
Bastien Mussard
1
168
1
1
250
Rollin A King
1
1.1K
1
1
250
Kalli Kappel
1
1.4K
2
1
250
James C Phillips
1
174
1
1
250
Haiyang Zhang
1
250
2
1
250
Jason W Labonte
1
1.4K
1
1
250
Jérôme F Gonthier
1
1.1K
1
1
250
Xiao Wang
1
1.1K
1
2
250
Matthew J O'meara
1
1.4K
1
1
250
Georgi L Stoychev
1
579
1
1
250
Felix A Faber
1
532
1
1
250
Sunhwan Jo
1
174
2
2
250
Yi Wang
1
163
1
1
250
Konrad Patkowski
1
1.1K
1
1
250
Bin Li
1
476
1
1
250
James E T Smith
1
168
1
1
250
Uğur Bozkaya
1
1.1K
1
1
250
Roberto Di Remigio
1
1.1K
1
1
250
Stefan Grimme
1
1.6K
9
2
250
Orlando Acevedo
1
476
1
1
250
Philip Shushkov
1
1.6K
1
1
250
David L Mobley
1
532
1
1
250
Hahnbeom Park
1
1.4K
1
1
250
Timothy C Berkelbach
1
214
2
2
250
Donghyuk Suh
1
174
1
1
250
Bing Huang
1
532
1
1
250
David van der Spoel
1
250
1
1
250
Xing Gao
1
340
1
1
250
Tanja Kortemme
1
1.4K
1
1
250
Daniele Fazzi
1
340
1
1
250
Adolfo B Poma
1
200
1
1
250
Marek Cieplak
1
200
3
1
250
Johannes Flick
1
166
1
2
250
Rebecca F Alford
1
1.4K
1
1
250
Patrick F Riley
1
532
1
1
250
Benjamin P Pritchard
1
1.1K
1
1
250
Alexander Yu Sokolov
1
1.1K
1
1
250
J Andrew Mccammon
1
163
1
2
250
Christoph Bannwarth
1
1.6K
4
1
250
Guillaume Jeanmairet
1
294
1
1
250
Yinglong Miao
1
163
2
2
250
Ryan M Richard
1
1.1K
1
1
250
Jeliazko R Jeliazkov
1
1.4K
1
1
250
Richard A Bonneau
1
1.4K
1
1
250
Andrew Leaver-Fay
1
1.4K
1
1
250
Yui Tik Pang
1
163
1
1
250
Brian Kuhlman
1
1.4K
1
1
250
Jin Zhang
1
250
1
1
250
Symon Gathiaka
1
476
1
1
250
C J Umrigar
1
294
1
1
250
Steven Kearnes
1
532
1
1
250
Brian Doherty
1
476
1
1
250
Jeffrey R Wagner
1
240
1
1
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