Journal of Chemical Theory and Computation

5.3(top 5%)

impact factor

9.0K(top 2%)

papers

410.1K(top 1%)

citations

229(top 1%)

h-index

5.4(top 5%)

extended IF

9.5K

all documents

441.0K

doc citations

425(top 1%)

g-index

Top Authors (by articles)

#	Author	Articles	Citations	R ARank	R CRank
1	Vicenzo Barone	9	448	1	1
3	Benedetta Mennucci	7	339	1	1
4	Siewert-Jan Marrink	6	1,780	1	1
4	Donald G Truhlar	6	360	1	2
6	Laura Gagliardi	5	261	2	4
6	Pavel Hobza	5	237	1	1
6	Marcus Elstner	5	392	1	1
6	Benoı̂t Roux	5	176	1	2
6	Niranjan Govind	5	327	1	1
6	Benoit Roux	5	176	1	2
12	D Peter Tieleman	4	1,213	2	1
12	Gábor I Csonka	4	108	1	1
12	Michele Parrinello	4	97	1	3
12	Jan Řezáč	4	384	1	1
12	Alexander D Mackerell	4	101	2	7
12	Kenneth M Merz Jr	4	395	1	1
12	Carles Curutchet	4	171	1	1
12	Denis Jacquemin	4	510	1	1
12	Martin Head-Gordon	4	171	2	4
12	Pengyu Ren	4	217	1	1
12	Pal D Mezei	4	108	1	1
12	Louis Lagardère	4	236	1	1
12	Helgi I Ingólfsson	4	1,662	1	1
12	Jacob Kongsted	4	150	1	2
12	Kenneth Ruud	4	144	1	2
12	Adrian H Elcock	4	135	1	1
12	Juan C Sancho García	4	195	1	1
12	Frank Noé	4	1,128	1	1
12	Frank Neese	4	912	3	1
31	Florian Weigend	3	343	1	1
31	Wonpil Im	3	417	1	1
31	Jiřı́ Šponer	3	542	2	1
31	Jean-Philip Piquemal	3	191	1	1
31	Carmen Domene	3	67	1	2
31	O Anatole Von Lilienfeld	3	756	1	1
31	Jeffrey B Neaton	3	433	1	2
31	Matteo Barborini	3	57	1	1
31	Sebastian Ehlert	3	312	1	3
31	Marco Caricato	3	125	1	1
31	Eberhard K U Gross	3	197	2	1
31	Giacomo Prampolini	3	143	1	1
31	Michal Otyepka	3	519	2	1
31	Juha Vaara	3	133	1	1
31	Rebecca K Carlson	3	173	2	2
31	Leonardo Guidoni	3	81	1	2
31	Erik R Lindahl	3	189	1	3
31	Gregory A Voth	3	93	2	6
31	Camille Latouche	3	140	1	1
31	David J Wales	3	56	2	4
31	William L Jorgensen	3	663	1	2
31	Christian Ochsenfeld	3	124	1	4
31	Dimitrios G Liakos	3	849	1	1
31	Todd J Martinez	3	184	2	2
31	Filippo Lipparini	3	143	1	1
31	Stefan Grimme	3	312	1	2
31	Shaul Mukamel	3	87	2	3
31	Carlos L Simmerling	3	7,456	1	1
31	Massimiliano Bonomi	3	336	1	1
31	David van der Spoel	3	192	1	1
31	Massimo Olivucci	3	190	1	1
31	Darrin M York	3	64	2	4
31	Ferdinand Evers	3	344	1	1
31	Martin Kaupp	3	136	1	1
31	Anders M N Niklasson	3	51	1	1
31	Vijay S Pande	3	134	2	4
31	Krishnan Raghavachari	3	113	1	2
31	Benjamin Stamm	3	143	1	1
31	Julien Bloino	3	193	1	1
31	Adrienn Ruzsinszky	3	89	1	3
72	Christopher Cramer	2	168	2	5
72	Zheng Zheng	2	34	1	2
72	Jay W Ponder	2	119	1	2
72	Roman A Laskowski	2	34	1	2
72	Dan Fraenkel	2	29	1	1
72	Jiří Mareš	2	121	1	1
72	Qiang Cui	2	72	1	5
72	Sergio Pantano	2	167	1	1
72	Marielle Soniat	2	72	1	1
72	Diogo Vila-Viçosa	2	66	1	1
72	Jiří Hostaš	2	34	1	1
72	Shu-Hua Li	2	65	1	1
72	Walter Thiel	2	125	3	2
72	Lin Lin	2	352	1	1
72	Miguel Machuqueiro	2	66	1	1
72	Adam Liwo	2	57	1	1
72	Neil Qiang Su	2	36	1	1
72	Christel M Marian	2	73	1	3
72	Chao Yang	2	315	1	1
72	Xiaosong Li	2	170	2	1
72	Maximilian Kubillus	2	269	1	1
72	K V Jovan Jose	2	79	1	1
72	Liel Sapir	2	42	1	2
72	Kasper Kristensen	2	127	1	1
72	Ramon Costa i Sala	2	27	1	1
72	Yu Zhang	2	60	1	1
72	Daniel H Friese	2	40	1	3
72	Haitao Sun	2	437	1	1
72	İlyas Yildirim	2	119	1	1
72	Nathan Luehr	2	137	2	2
72	Ya-Jun Liu	2	110	1	1
72	Ruge Quhe	2	30	1	4
72	Robert Zalesny	2	53	1	1
72	Philippe Derreumaux	2	126	1	3
72	Hilke Bahmann	2	123	1	1
72	Jaakko J Uusitalo	2	475	1	1
72	Giovanni Bussi	2	118	2	2
72	Cecilia Clementi	2	227	1	1
72	Luca Muccioli	2	125	1	1
72	Jochen Autschbach	2	107	2	3
72	Mingjun Yang	2	73	1	1
72	Sergio Paz	2	25	1	1
72	Wolfgang Wenzel	2	78	1	2
72	Fan Jiang	2	50	1	2
72	Andrew M Teale	2	104	1	1
72	Aatto I Laaksonen	2	23	3	4
72	Ivo Cacelli	2	77	1	1
72	Tristan Bereau	2	208	1	1
72	Lluís Blancafort	2	76	1	1
72	Xavier Blase	2	380	1	1
72	Nanna Holmgaard List	2	89	1	2
72	Hans-Joachim Werner	2	185	2	1
72	Huai Sun	2	48	1	1
72	Marco Garavelli	2	68	2	2
72	Toru Shiozaki	2	51	1	2
72	Julie Anne Harris	2	32	1	1
72	Edgar Núñez-Rojas	2	65	1	1
72	Vítor H Teixeira	2	66	1	1
72	Emanuele Penocchio	2	170	1	1
72	Daniel Gryko	2	106	5	6
72	Masahiro Ehara	2	74	1	2
72	Ken A Dill	2	145	3	2
72	Matthew B Goldey	2	107	1	2
72	Pratyush Tiwary	2	30	1	4
72	Tomáš Kubař	2	280	1	1
72	Adam K Sieradzan	2	57	1	1
72	Pengfei Li	2	353	1	1
72	Carlo Adamo	2	134	1	1
72	Ibério De P R Moreira	2	27	1	2
72	Pavlo O Dral	2	665	1	1
72	Daniel Harries	2	42	1	3
72	Gerhard Stock	2	99	2	2
72	Michael Gilson	2	132	1	1
72	Bryan M Wong	2	142	1	1
72	Adri van Duin	2	65	2	8
72	Bernard R Brooks	2	48	1	5
72	Giovanni Li Manni	2	110	1	1
72	Patrice Malfreyt	2	64	1	1
72	Giovanni Scalmani	2	30	1	1
72	Dimitrios Skouteris	2	123	1	1
72	Fabio Pietrucci	2	61	1	2
72	Silvana Botti	2	46	1	4
72	Trygve Helgaker	2	104	1	1
72	alberto Perez	2	134	1	2
72	Akio Kitao	2	53	1	1
72	Xin Xu	2	36	1	3
72	Stanislav Komorovsky	2	104	2	1
72	Qiantao Wang	2	119	1	1
72	Anna Tramontano	2	25	2	5
72	Erin Johnson	2	61	2	2
72	Edward F C Byrd	2	72	1	1
72	Jiří Vondrášek	2	34	1	1
72	Tsjerk A Wassenaar	2	941	1	1
72	Samer Gozem	2	165	1	1
72	António M Baptista	2	66	1	1
72	Konstantinos D Vogiatzis	2	80	2	3
72	Lucas Visscher	2	58	1	1
72	Robert B Best	2	35	2	5
72	Niel M Henriksen	2	132	1	1
72	Charles L Brooks	2	45	2	4
72	Betsy M Rice	2	72	1	1
72	Alán Aspuru Guzik	2	33	2	14
72	Marco Nava	2	30	1	1
72	Syed Awais Rouf	2	121	1	1
72	Peter V Coveney	2	157	1	1
72	Marc Cawkwell	2	25	1	3
72	Paolo Carloni	2	85	2	1
72	Kenneth Lopata	2	136	1	1
72	Rainer Arnold Böckmann	2	941	1	1
72	Philippe H Hünenberger	2	26	2	1
72	Olga V Kalinina	2	35	1	2
72	Shuxiang Li	2	29	1	1
72	So Hirata	2	81	2	2
72	N Scott Weingarten	2	72	1	1
72	James P Larentzos	2	72	1	1
72	Matías Rodrigo Machado	2	167	1	1
72	Daniel Reta	2	27	1	2
72	Miguel A L Marques	2	46	1	5
72	Henry F Schaefer	2	15	6	11
72	Thomas E Cheatham	2	518	1	1
72	Ramón Hernández-Lamoneda	2	21	1	1
72	Julien Michel	2	54	1	2
72	Michael A Robb	2	57	1	2
72	Hui Chen	2	97	2	3
72	Michiel Jan van Setten	2	322	1	1
72	Michal Repisky	2	104	2	2
72	Aziz Ghoufi	2	64	1	2
72	Fabio Sterpone	2	101	2	3
72	Roberto Improta	2	76	2	3
72	Mihaly Kallay	2	73	2	2
72	Juyong Lee	2	48	1	1
72	Michael J Schnieders	2	98	1	1
72	Ferruccio Palazzesi	2	118	1	1
72	Andreas Hansen	2	124	1	3
72	Liao Y Chen	2	72	1	1
72	Francesc Illas Riera	2	27	2	9
72	Yoan Olivier	2	125	1	3
72	Thomas Heine	2	97	3	11
72	Mónica Moral	2	125	1	1
72	Yifei Qi	2	399	3	1
72	J Andrew Mccammon	2	598	1	1
72	Jose Alejandre	2	65	1	1
72	Emanuele Coccia	2	60	1	1
72	Michael Grabe	2	141	1	1
72	Oded Hod	2	61	1	1
72	Thomas Lengauer	2	35	1	1
72	Russo Nino	2	48	2	5
72	Mazen Ahmad	2	35	1	1
72	Sahar Sharifzadeh	2	343	1	1
72	David Jakubec	2	34	1	1
72	Yun-Dong Wu	2	50	1	6
72	Yuki Kurashige	2	82	1	3
72	Ivan Duchemin	2	380	1	1
72	B Montgomery Pettitt	2	30	1	2
72	Timothy J Giese	2	54	1	1
72	S Alexis Paz	2	25	1	1
72	Andrew T Fenley	2	132	1	1
72	Thomas K Haxton	2	24	1	3
72	Patrick J Lestrange	2	170	1	1
72	Michael K Gilson	2	132	1	1
72	Michael Gaus	2	257	1	1
72	Patrick Ettenhuber	2	91	1	1
238	Cristian Moya	1	274	1	1
238	Rodrigo Galindo-Murillo	1	392	1	1
238	Marco Govoni	1	255	1	1
238	Manuel N Melo	1	236	1	1
238	Carolina Cragnell	1	217	1	1
238	João Henriques	1	217	1	1
238	Jean-Luc E Bredas	1	362	5	1
238	Julian Tirado-Rives	1	611	1	1
238	David Baker	1	204	8	7
238	Sarah Rauscher	1	368	1	1
238	Fabio Caruso	1	280	2	1
238	Jan M L Martin	1	544	1	1
238	Philip Bradley	1	204	1	2
238	Jumin Lee	1	340	1	1
238	Matthias Scheffler	1	280	4	2
238	Fabian Paul	1	876	1	1
238	Lin Frank Song	1	334	1	1
238	Xavier Periole	1	236	1	1
238	Markus Zweckstetter	1	368	4	2
238	Matthias S Rupp	1	579	2	2
238	Matthew J O'meara	1	204	1	1
238	Helmut Grubmüller	1	368	2	1
238	Xinguo Ren	1	280	3	1
238	Petr Jurečka	1	392	2	1
238	Jack Scott Snoeyink	1	204	1	1
238	Alex H De Vries	1	236	1	1
238	Frank Jensen	1	235	1	2
238	Kevin E Hauser	1	7,322	1	1
238	Andreas Klamt	1	274	1	2
238	Amelie Stein	1	204	1	1
238	Patrick Rinke	1	280	2	1
238	Edward J Maginn	1	249	3	1
238	Vytautas Gapsys	1	368	1	1
238	Raghunathan Ramakrishnan	1	579	3	2
238	Frank DiMaio	1	204	4	4
238	Giulia Galli	1	255	1	1
238	Manoj Kumar Kesharwani	1	544	1	1
238	Tanja Kortemme	1	204	1	1
238	Marie Skepö	1	217	1	1
238	Guillermo Pérez-Hernández	1	876	1	1
238	Christoph Wehmeyer	1	876	1	1
238	Moritz Hoffmann	1	876	1	1
238	Johannes Lischner	1	280	2	1
238	Marcelo F Masman	1	236	1	1
238	Michael D Tyka	1	204	1	1
238	Steven G Louie	1	280	4	5
238	Marie Zgarbova	1	392	2	1
238	Michael Joseph Robertson	1	611	1	1
238	Bert L De Groot	1	368	3	2
238	Yinglong Miao	1	544	2	1
238	Adrian E Roitberg	1	896	1	1
238	Lauren Wickstrom	1	7,322	1	1
238	Manuel Sparta	1	544	1	1
238	José Palomar	1	274	1	1
238	Andrew Leaver-Fay	1	204	1	1
238	Brian Kuhlman	1	204	2	3
238	Clément Arnarez	1	236	1	1
238	Jan-Hendrik Prinz	1	876	1	1
238	Scott Le Grand	1	896	1	1

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