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	Donald G Truhlar	11	1,813	1	1
2	Jiali Gao	5	593	1	1
3	Alexander D Mackerell	4	492	1	1
3	William L Jorgensen	4	261	1	1
3	Orlando Acevedo	4	196	1	1
6	Christopher Cramer	3	556	2	1
6	Patrizia Calaminici	3	48	1	2
6	Ursula Röthlisberger	3	169	2	2
6	Aleksandr V Marenich	3	556	1	1
6	Paul Ayers	3	258	2	3
6	Russo Nino	3	66	2	3
12	Francesco Lelj	2	47	1	1
12	Weitao Yang	2	260	3	2
12	Ivano Tavernelli	2	91	2	3
12	Qiang Cui	2	171	1	2
12	Jean-Philip Piquemal	2	416	1	1
12	Zeferino Gómez-Sandoval	2	20	1	1
12	Walter Thiel	2	100	1	9
12	Russell J Boyd	2	162	1	1
12	Nohad Gresh	2	416	1	1
12	Ignacio Soteras	2	75	1	1
12	O Anatole Von Lilienfeld	2	122	1	2
12	François Dehez	2	75	1	1
12	James S M Anderson	2	239	1	1
12	Kenneth M Merz Jr	2	318	3	1
12	Michael L Klein	2	211	1	2
12	Yan Zhao	2	764	1	1
12	Jan H Jensen	2	47	1	5
12	Richard A Friesner	2	133	1	3
12	János Ángyán	2	75	1	2
12	Ken A Dill	2	584	1	1
12	Ulrike Salzner	2	82	1	1
12	Thomas Frauenheim	2	244	5	3
12	Igor V Vorobyov	2	369	1	1
12	Junchao Xia	2	47	1	1
12	Benoı̂t Roux	2	223	1	2
12	Daan P Geerke	2	92	1	1
12	Carlos L Simmerling	2	404	1	1
12	Ryan P Daly	2	47	1	1
12	F Javier Luque	2	75	1	3
12	Jeanet Conradie	2	146	1	3
12	Abhik Ghosh	2	146	1	3
12	Christophe Chipot	2	75	1	1
12	Darrin M York	2	176	1	2
12	Henry F Schaefer	2	90	3	6
12	Thomas E Cheatham	2	880	1	2
12	Feng-Chuan Chuang	2	47	1	1
12	John D Chodera	2	584	1	1
12	Claudio J Margulis	2	47	1	3
12	Tiziana Marino	2	28	1	4
12	Michael R Shirts	2	133	1	3
12	Junia Melin	2	239	1	1
12	Benoit Roux	2	223	1	2
12	Kai Zhu	2	133	1	1
57	Andriy Kovalenko	1	57	1	3
57	Scott A Showalter	1	231	2	1
57	John F Stanton	1	21	1	4
57	Jay W Ponder	1	66	1	3
57	Massimo Rudan	1	4	3	4
57	Sergei Tretiak	1	295	6	4
57	Jill E Gready	1	13	1	1
57	Preston B Moore	1	151	1	1
57	Hiromi Nakai	1	46	7	5
57	Leif A Eriksson	1	10	6	8
57	Rafael Islas	1	53	1	4
57	Tomasz A Wesolowski	1	45	1	1
57	Luís F Veiros	1	17	2	4
57	Rebecca C Wade	1	25	2	4
57	Emilia Sicilia	1	38	2	2
57	Patrik Rydberg	1	54	1	1
57	Johannes Kästner	1	48	1	2
57	Manuel Jimenez-Estrada	1	4	1	3
57	Matthew Jacobson	1	29	1	5
57	Jakub Kaminsky	1	65	1	1
57	Giuliano Alagona	1	48	1	1
57	Michele Parrinello	1	151	5	5
57	G Andrés Cisneros	1	312	1	1
57	Takashi Kubo	1	41	2	8
57	Ibon Alkorta	1	8	9	15
57	Renata Tokarz-Sobieraj	1	22	1	1
57	Mark S Gordon	1	115	1	2
57	Rui-Qin Zhang	1	36	4	6
57	Enrico Piccinini	1	4	2	2
57	Georg Eickerling	1	65	1	1
57	H Bernhard Schlegel	1	168	1	1
57	Kim Baldridge	1	35	2	3
57	Klaus Schulten	1	34	1	3
57	Cherumuttathu H Suresh	1	15	3	9
57	Sourav Pal	1	28	1	1
57	F Marty Ytreberg	1	4	1	1
57	Andrew Almond	1	16	1	5
57	Yannick J Bomble	1	21	1	2
57	Ulf Ryde	1	54	2	4
57	Guillaume Lamoureux	1	60	1	2
57	Daniel M Zuckerman	1	4	2	4
57	Ramon Costa i Sala	1	113	1	1
57	Joseph J W Mcdouall	1	15	1	3
57	Antonio Frontera	1	20	1	7
57	Pilar Redondo	1	27	3	3
57	Martin B Ulmschneider	1	30	1	3
57	Hans-Jörg Himmel	1	65	3	3
57	Luigi Delle Site	1	55	5	5
57	Hélio Anderson Duarte	1	31	1	6
57	Hans Martin Senn	1	48	1	2
57	Pablo Ballester	1	20	1	9
57	Chérif F Matta	1	34	2	3
57	Andreas Savin	1	5	1	4
57	Nivan Bezerra da Costa Junior	1	27	1	2
57	Edith Botek	1	41	4	5
57	Ronald M Levy	1	45	1	3
57	Stefano Evangelisti	1	15	1	1
57	Feliu Maseras	1	52	4	5
57	Barbara Kirchner	1	4	1	7
57	Jesus M Ugalde	1	8	3	6
57	Eliseo Ruiz	1	41	3	3
57	Alessandro Laio	1	78	1	3
57	R Bruce King	1	71	2	2
57	Victor D Lakhno	1	7	1	2
57	Ian H Williams	1	22	1	1
57	Toon Verstraelen	1	19	1	2
57	Dorota Rutkowska-Zbik	1	22	1	1
57	YIhan Shao	1	44	2	2
57	Michael Feig	1	66	1	1
57	Jochen Autschbach	1	43	6	7
57	Antonio Monari	1	15	1	3
57	Wolfgang Wenzel	1	3	2	7
57	Thomas A Niehaus	1	36	3	5
57	Paolo Lazzeretti	1	14	3	5
57	Raviprasad Aduri	1	168	1	1
57	Gerd B Rocha	1	27	2	2
57	Ivo Cacelli	1	102	1	1
57	Akin Akdag	1	8	1	6
57	Raffaele Borrelli	1	35	1	1
57	Carles Curutchet	1	41	3	3
57	Chun Wu	1	35	1	3
57	Małgorzata Witko	1	22	1	1
57	Cezary Czaplewski	1	45	2	2
57	Eric V Patterson	1	12	1	2
57	Qi-Shi Du	1	27	1	1
57	Ana Martinez	1	0	2	4
57	Giacomo Prampolini	1	102	2	1
57	Rossella Brunetti	1	4	2	2
57	Enrico Tapavicza	1	66	1	2
57	Jing Kong	1	9	1	1
57	Setsuko Nakagawa	1	18	1	1
57	James A Platts	1	136	1	1
57	David L Mobley	1	168	2	6
57	Michael Bühl	1	154	1	1
57	Michel Etienne	1	52	1	1
57	Emil Proynov	1	9	1	1
57	Sarah L Price	1	52	2	3
57	Alexei M Shor	1	21	1	3
57	Anthony J Day	1	16	3	6
57	Chaok Seok	1	416	1	1
57	Paulina M Dominiak	1	134	2	1
57	Alfredo Guevara-García	1	0	2	2
57	Claudio F Tormena	1	9	3	6
57	Michael Filatov	1	113	1	1
57	Jochen Blumberger	1	60	1	1
57	John M Herbert	1	93	1	1
57	Axel Bidon-Chanal Badia	1	41	1	2
57	Daniel Escudero	1	20	1	5
57	Mariusz Radon	1	36	1	1
57	Bruce J Palmer	1	2	1	1
57	Alessandra Magistrato	1	52	2	2
57	Troy W Whitfield	1	87	1	1
57	Dimitrios A Pantazis	1	52	1	2
57	Shuanghong Huo	1	14	2	2
57	Viktor Hornak	1	70	1	2
57	Robert J Woods	1	27	1	2
57	Per-Ola Norrby	1	54	1	2
57	Richard W Pastor	1	233	1	1
57	Ruslan Kevorkyants	1	94	1	1
57	Emilio Gallicchio	1	45	1	2
57	John SantaLucia	1	168	1	1
57	Ibério De P R Moreira	1	113	1	1
57	Noriaki Okimoto	1	13	1	2
57	Mark A Vincent	1	73	1	1
57	Jeremy C Smith	1	56	3	6
57	Jingzhi Pu	1	107	1	1
57	Michael L Mckee	1	8	2	2
57	Victoria A Higman	1	16	1	2
57	Marcus Elstner	1	208	2	2
57	Da-Wei Li	1	14	2	2
57	Vasiliy S Znamenskiy	1	43	1	1
57	Hai Lin	1	65	1	3
57	Masayoshi Nakano	1	41	6	7
57	René Fournier	1	53	1	1
57	Ricardo O Freire	1	27	3	5
57	Pascal Auffinger	1	159	1	1
57	Olga Kronja	1	18	1	2
57	Michael E Foster	1	12	1	1
57	Kent S Gates	1	17	3	4
57	Martin Head-Gordon	1	44	3	6
57	Benedetta Mennucci	1	9	4	7
57	Hideaki Takahashi	1	41	5	5
57	Frank Jensen	1	65	1	4
57	Stanislaw Oldziej	1	45	2	2
57	Paul Sherwood	1	48	1	2
57	Santiago Alvarez	1	41	3	3
57	Akihiro Furube	1	36	1	4
57	Notker Rösch	1	21	3	6
57	Bernd Ensing	1	151	1	1
57	Alexey V Onufriev	1	334	1	1
57	Dario A Estrin	1	14	1	7
57	Trygve Helgaker	1	43	3	5
57	Shantenu Jha	1	16	1	2
57	Georgi N Vayssilov	1	21	3	3
57	Willem Klopper	1	28	5	8
57	I-Feng W Kuo	1	110	1	1
57	Mark A Olson	1	26	1	1
57	William C Swope	1	416	1	1
57	Douglas J Klein	1	19	1	1
57	Shin-ichiro Sato	1	9	1	1
57	Clarissa O Da Silva	1	9	1	1
57	Henry Chermette	1	10	1	8
57	Thereza A Soares	1	19	1	1
57	Nathan A Baker	1	42	2	3
57	Eli Pollak	1	1	2	4
57	Paola Gori-Giorgi	1	5	1	2
57	Ryohei Kishi	1	41	4	6
57	Lichang Wang	1	15	2	3
57	Andrea Peluso	1	35	1	1
57	Edward J Maginn	1	188	2	3
57	Luciana Guimaraes	1	31	1	3
57	J Grant Hill	1	136	1	1
57	Mariangela Di Donato	1	35	1	2
57	Kasper P. Kepp	1	73	1	2
57	Zhong-Zhi Yang	1	39	1	1
57	Ewa Broclawik	1	36	2	1
57	Alessandro Soncini	1	33	1	2
57	Maria Jose' Calhorda	1	17	3	6
57	Charles Edwin Webster	1	14	1	2
57	Adrià Gil	1	41	1	3
57	Mauricio Coutinho-Neto	1	66	1	2
57	Wei Shi	1	188	1	1
57	Kenji Kamada	1	41	3	7
57	Maria J. Ramos	1	12	6	14
57	Lars Olsen	1	54	1	2
57	Hiroto Tachikawa	1	11	4	5
57	Hiroshi Nakatsuji	1	134	2	2
57	Alpeshkumar K Malde	1	5	1	6
57	Riccardo Zanasi	1	14	2	4
57	Kendall Houk	1	33	2	4
57	Vladislav B Sultanov	1	7	1	1
57	Hiroyuki Shinto	1	10	1	2
57	Arun Yethiraj	1	33	2	3
57	Modesto Orozco López	1	41	1	11
57	Marc M Messerschmidt	1	134	2	1
57	Peter V Coveney	1	16	1	2
57	Andrea C Vaiana	1	159	1	1
57	David Casanova	1	57	1	1
57	Kalyan Das	1	45	2	4
57	John E Mcgrady	1	52	1	3
57	Henryk A Witek	1	208	2	1
57	Janet E Del Bene	1	8	4	5
57	Tzonka Mineva	1	94	1	1
57	Jose Elguero	1	8	8	21
57	Dan Thomas Major	1	86	1	1
57	Wolfgang Scherer	1	65	2	2
57	Antonio Costa	1	20	1	5
57	Markus Reiher	1	65	3	6
57	Yutaka Imamura	1	46	1	1
57	Karl Sohlberg	1	12	1	1
57	So Hirata	1	29	2	4
57	Wilfred F Van Gunsteren	1	52	3	2
57	David Quiñonero	1	20	1	7
57	Jun-ya Hasegawa	1	134	1	1
57	Junyong Wu	1	20	1	1
57	Jorge Barroso	1	53	2	4
57	Evans Clifton Coutinho	1	5	2	8
57	Jessica M J Swanson	1	42	1	2
57	Pere M Deyà	1	20	1	8
57	Carmen Barrientos	1	27	3	3
57	Ahren W Jasper	1	6	2	5
57	J Andrés	1	31	2	7
57	Mariona Sodupe	1	41	3	4
57	Lev D Gelb	1	6	1	3
57	Mihaly Mezei	1	3	1	2
57	Michael B Hall	1	14	2	7
57	Julien Michel	1	43	1	1
57	Elixabete Rezabal Astigarraga	1	8	1	4
57	William F Polik	1	21	1	1
57	Pierre-Francois Loos	1	14	2	2
57	Gabriel Waksman	1	16	1	3
57	Fabio Affinito	1	4	2	2
57	Kwangho Nam	1	138	1	1
57	Wei Han	1	42	1	1
57	Samuel Krimm	1	8	1	1
57	Manuel Yanez	1	8	4	9
57	Philip W Fowler	1	16	1	4
57	Jakob P Ulmschneider	1	30	1	2
57	Roberto Improta	1	102	4	4
57	Rajeev Prabhakar	1	208	1	1
57	Djamaladdin G Musaev	1	208	3	1
57	Michael J Schnieders	1	66	1	2
57	Celestino Angeli	1	15	2	6
57	Christopher J Mundy	1	110	1	1
57	Julio C Facelli	1	17	1	3
57	Andrei V Pisliakov	1	304	1	1
57	Susan B Rempe	1	87	1	2
57	Valerije Vrček	1	18	1	1
57	Mark P Waller	1	154	1	1
57	Kurt Kremer	1	55	2	6
57	Sergey Gusarov	1	57	1	1
57	Johan Åqvist	1	112	2	1
57	Francesc Illas Riera	1	113	4	7
57	Tai-Sung Lee	1	38	1	1
57	Mark E Tuckerman	1	56	1	3
57	Veronique Van Speybroeck	1	19	4	10
57	David A Case	1	334	2	1
57	Jason A Wagoner	1	42	1	1
57	Mark Gordon	1	115	2	3
57	Thomas Heine	1	53	2	7
57	Hidenori Matsuzawa	1	12	1	1
57	J Ilja Siepmann	1	14	1	5
57	Otilia Mo Romero	1	8	4	9
57	Edward Arnold	1	45	2	1
57	Jonathan W Essex	1	43	1	2
57	Shigehiko Hayashi	1	134	1	1
57	Christian Gossens	1	25	1	2
57	Pedro Alexandrino Fernandes	1	12	5	10
57	John P Robinson	1	15	1	1
57	John T Mongan	1	334	1	1
57	Nico F A Van Der Vegt	1	19	1	4
57	Irina Moreira	1	12	1	6
57	J Andrew Mccammon	1	40	3	7
57	Peter L Cummins	1	13	1	1
57	Corinne Lacaze-Dufaure	1	39	1	1
57	Faraj Hasanayn	1	7	1	1
57	Jingjing Zheng	1	207	2	1
57	Steven Nielsen	1	151	1	1
57	Ivan Infante	1	9	1	3
57	Rafael Brüschweiler	1	231	3	1
57	Alfredo M Simas	1	27	2	2
57	Rainer E Glaser	1	17	1	3
57	Benoît Ît Champagne	1	41	6	7
57	Yong Duan	1	35	2	6
57	Bojan Zagrovic	1	48	1	1
57	Michał Jaszuński	1	43	1	1
57	Marta B Ferraro	1	17	1	1
57	Ko Higashitani	1	10	1	1
57	Cristiano Ruch Werneck Guimarães	1	3	1	3
57	Benzhuo Lu	1	40	1	2
57	Xavier Assfeld	1	14	3	5
57	Peter Pulay	1	64	2	4
57	Yun-Dong Wu	1	42	1	1
57	Jay C Amicangelo	1	14	1	1
57	Caterina Ghio	1	48	1	1
57	Jens Carlsson	1	112	1	1
57	Friedrich Matthias Bickelhaupt	1	108	5	5
57	Xiao Cheng Zeng	1	21	3	9
57	José Maria Mercero	1	8	2	5
57	Liem X Dang	1	110	1	1
57	Massimo Marchi	1	9	1	2
57	Sílvia Simon Rabasseda	1	41	1	2
57	Xiao Zhu	1	33	1	1
57	Carlos Silva-López	1	38	1	1
57	Antonio Largo	1	27	2	2
57	Daniel Borgis	1	9	1	3
57	Luis Rodriguez-Santiago	1	41	2	2
57	Stephan Irle	1	208	3	1
57	Víctor Polo	1	31	1	2
57	Hans Ågren	1	18	2	3
57	Marirosa Toscano	1	20	1	4
57	Håkan Wilhelm Hugosson	1	78	1	1
57	Ujjal Sarkar	1	17	1	2
57	Christopher M Baker	1	38	1	2
57	Mohamed A Osman	1	19	1	1
57	Ignacio Soteras Gutiérrez	1	34	1	1
57	Arturo Robertazzi	1	52	1	1
57	Zhen Hua Li	1	17	1	4
57	Gabriela Barreiro	1	3	1	3
57	Pedro A Fernandes	1	12	2	7
57	Philip Coppens	1	134	1	1
57	Alexander D Mackerell Jr	1	107	1	1
57	Edward Harder	1	87	1	1
57	Asim Okur	1	70	2	2
57	Maeng-Eun Lee	1	19	1	1
57	Guishan Zheng	1	208	1	1
57	Vinod Tipparaju	1	2	1	1
57	Guanglei Cui	1	70	2	1
57	Jed W Pitera	1	416	1	1
57	Eddy Arnold	1	45	1	3
57	Li Han	1	14	1	2
57	William G Scott	1	38	1	3
57	Ivan V Rostov	1	13	1	1
57	Jorge Aguilera-Iparraguirre	1	28	1	1

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