Computational and Theoretical Chemistry

2.6(top 20%)

impact factor

4.5K(top 5%)

papers

40.1K(top 10%)

citations

56(top 10%)

h-index

2.6(top 20%)

extended IF

4.8K

all documents

42.0K

doc citations

80(top 10%)

g-index

Top Authors (by articles)

#	Author	Articles	Citations	R ARank	R CRank
1	Mansour Zahedi	4	40	1	1
1	Masoud Arabieh	4	40	1	1
3	Kumaradhas Poomani	3	22	1	3
3	Ibon Alkorta	3	64	4	5
3	Wen-Jing Shi	3	25	1	1
3	Goar Sánchez-Sanz	3	62	2	5
3	Pascal Larregaray	3	40	1	2
3	Jijun Zhao	3	112	1	9
3	Zhongmin Su	3	24	9	23
3	Wojciech P Oziminski	3	30	1	2
3	Jose Elguero	3	64	4	5
3	Fu-de Ren	3	25	1	1
13	Andrei N Enyashin	2	271	1	1
13	Russell J Boyd	2	6	1	4
13	Long-Jiu Cheng	2	58	2	2
13	Shaoli Liu	2	9	1	1
13	Andrzej Nowacki	2	17	1	2
13	Antonio Frontera	2	19	2	8
13	Mei-Shan Wang	2	11	2	5
13	Saied M Soliman	2	23	1	1
13	Sierra Rayne	2	17	1	1
13	Chuan-Lu Yang	2	11	2	4
13	Cristina Trujillo	2	50	1	3
13	Rahim Ghadari	2	8	1	2
13	Yunsheng Xue	2	66	1	1
13	Jordi Poater	2	53	1	1
13	Mina Ghiasi	2	32	1	1
13	Tianlei Zhang	2	19	1	2
13	Kentaro Doi	2	19	1	1
13	Ying Xue	2	63	1	2
13	Laurent Bonnet	2	23	1	1
13	Pei-Yu Zhang	2	13	2	4
13	Piotr Matczak	2	59	1	2
13	Jiangfeng Gong	2	9	1	5
13	Zhiyuan Geng	2	9	1	1
13	Yuji Mochizuki	2	31	2	2
13	Mohammad Reza Momeni Taheri	2	4	1	2
13	Barbara Dmochowska	2	17	1	1
13	Poonam Tandon	2	53	2	1
13	Dongxu Tian	2	32	1	1
13	Ahmed M El-Nahas	2	16	1	1
13	Animesh K Ojha	2	22	1	2
13	David Quiñonero	2	19	1	5
13	Junyong Wu	2	16	1	1
13	Pere M Deyà	2	19	1	6
13	Mahdi D Esrafili	2	64	1	2
13	Mehdi Yoosefian	2	69	2	2
13	Karol Sikora	2	17	1	1
13	Huai-Qian Wang	2	23	1	1
13	Chunmei Tang	2	9	1	1
13	Haydar Raissi	2	69	2	2
13	Hui-Li Xu	2	76	2	2
13	Ali Ahmadi	2	143	7	9
13	Vladimír Lukeš	2	63	1	2
13	Guochun Yang	2	25	1	3
13	Hui-Fang Li	2	23	1	1
13	Ludovic Martin-Gondre	2	45	2	3
13	Jincheng Du	2	33	2	4
13	Kalyan Kumar Das	2	29	1	2
13	Fabien Gatti	2	22	2	3
13	Poonam Rawat	2	53	1	2
62	Cong Chen	1	45	1	1
62	Irma Chacón	1	2	1	2
62	Teresa Rodriguez-Blas	1	54	2	3
62	Bisheng Tan	1	34	2	1
62	Shigeaki Morita	1	5	1	3
62	Jerzy Leszczynski	1	6	8	21
62	Marisol Güizado-Rodríguez	1	0	1	0
62	Rafik Karaman	1	5	3	6
62	Jinxiang Dong	1	11	4	8
62	Yan Su	1	2	1	4
62	Viwat Vchirawongkwin	1	1	1	6
62	George C Schatz	1	22	5	10
62	Wolfgang Windl	1	13	1	6
62	Murat Duran	1	2	1	2
62	Alimi Kamel	1	22	4	2
62	Ivana Djordjevic	1	2	1	2
62	Ana Martin-Somer	1	33	1	1
62	Qingfeng Ge	1	9	1	7
62	Yan-Bo Wu	1	18	2	3
62	S Hooman Vahidi	1	16	1	1
62	Sean P Collins	1	5	1	1
62	Qiang Zhao	1	11	1	5
62	Piotr Cysewski	1	3	1	3
62	Vitaly V Porsev	1	4	1	2
62	David Esteban	1	54	2	3
62	Leonardo Lo Presti	1	164	2	2
62	Vicenzo Barone	1	13	4	9
62	Mirosław Jabłoński	1	26	2	2
62	Jean-Philip Piquemal	1	41	3	3
62	Ramón Sayós	1	17	2	3
62	Pascal Honvault	1	8	2	4
62	Blas P Uberuaga	1	13	3	9
62	Ahmad Irfan	1	23	3	6
62	Wei Guan	1	7	3	6
62	Karel D Klika	1	3	1	4
62	Paola Benzi	1	6	1	1
62	Xuefeng Fu	1	13	1	2
62	Maria G Khrenova	1	8	1	2
62	Felice Grandinetti	1	6	1	1
62	Qi-Jun Liu	1	7	1	2
62	Ting-Jun Hou	1	13	6	12
62	Yongliang Yong	1	14	1	2
62	Hossein Roohi	1	4	1	3
62	Tapan K Ghanty	1	1	4	6
62	Wang Kedong	1	0	1	2
62	Somsak Pianwanit	1	9	1	3
62	Ernani A Basso	1	6	1	1
62	Ulf Ryde	1	30	2	7
62	Qiang Zhao	1	11	1	4
62	Anne M Chaka	1	25	1	1
62	Agusti Lledos	1	18	4	10
62	Sridhar Sahu	1	2	1	1
62	Xiao-Ying Zhang	1	1	2	11
62	Elena S Shubina	1	18	1	4
62	Ram Devanathan	1	23	1	3
62	Anne-Marie Kelterer	1	2	1	1
62	Lin Du	1	9	2	3
62	Bill Poirier	1	23	2	2
62	Yu Harabuchi	1	7	1	1
62	Beata Szefler	1	3	2	5
62	Kanekazu Seki	1	13	1	1
62	Joaquim C G Esteves Da Silva	1	11	5	11
62	George Maroulis	1	8	1	3
62	Andres de Blas	1	54	2	3
62	Ricardo Diez Muino	1	28	2	5
62	Ernesto Garcia	1	15	2	3
62	Aleksey E Kuznetsov	1	42	1	1
62	Xian-you Wang	1	20	8	13
62	Tao Liu	1	9	1	1
62	Stephane Tesson	1	11	1	1
62	Mikhail V Ryzhkov	1	36	1	1
62	Alireza Fattahi	1	23	3	5
62	Wei Wang	1	13	1	4
62	Abdulhakim A Ahmed	1	2	1	1
62	Abdelkrim A Roumili	1	10	1	1
62	Mahmoud Mirzaei	1	7	3	3
62	Natalia V Belkova	1	18	1	3
62	Stephen J Jenkins	1	20	2	3
62	Jochen Autschbach	1	22	4	9
62	Fu-Quan Bai	1	3	4	11
62	Antonio Monari	1	55	3	1
62	Angela K Wilson	1	10	5	6
62	Dmitry I Morozov	1	8	1	2
62	Xiuhui Zhang	1	1	2	2
62	Szilárd Varga	1	8	1	2
62	S Ali Beyramabadi	1	16	2	2
62	Houshang Najafi	1	17	2	2
62	Nabanita Saikia	1	15	1	3
62	Wenhui Duan	1	4	3	9
62	Kameron R Jorgensen	1	10	1	1
62	Alireza Najafi Chermahini	1	19	1	3
62	Alejandro Toro-Labbe	1	4	2	8
62	Boaz Oliveira	1	33	1	1
62	Willian R Rocha	1	7	2	6
62	Marcin Palusiak	1	40	3	3
62	Carlo Gatti	1	164	1	2
62	Joaquin Espinosa-Garcia	1	15	2	4
62	Denis Chachkov	1	3	4	5
62	Li-Hua Gan	1	0	2	6
62	Li Yang	1	4	1	1
62	Nelly Gonzalez-RIvas	1	11	1	2
62	Donghai Mei	1	9	3	7
62	Weihua Zhu	1	50	2	2
62	Ricardo Perez de Tudela	1	10	1	3
62	Weichao Zhang	1	6	1	1
62	Aurelie Perrier	1	11	1	6
62	William Hase	1	4	4	11
62	Christine M Aikens	1	18	3	6
62	Roman Leitsmann	1	5	1	1
62	Marie-Christine Bacchus-Montabonel	1	29	2	2
62	Vikas D Ghule	1	15	1	4
62	James A Platts	1	20	3	6
62	Yuji Kohno	1	13	1	1
62	Todd M Alam	1	13	1	2
62	Manef Abderrabba	1	9	3	12
62	Chun-Guang Liu	1	1	1	5
62	Jon Uranga	1	30	1	1
62	Maite Alducin	1	28	2	5
62	Rodrigo M Pontes	1	6	1	1
62	Tetsuya Taketsugu	1	7	4	8
62	Federico Palazzetti	1	47	1	1
62	Najoua Derbel	1	5	1	3
62	Hsin-Tsung Chen	1	9	2	4
62	Michał A Dobrowolski	1	15	1	2
62	Udo Schnupf	1	7	2	3
62	Al Mokhtar lamsabhi	1	33	1	1
62	Jarosław Handzlik	1	5	1	3
62	Amar M Kamat	1	11	1	2
62	Natalia Linde	1	8	1	1
62	Ali Morsali	1	16	7	7
62	Houlei Gan	1	6	1	2
62	Miquel Solà	1	21	4	5
62	Nico Sanna	1	13	1	2
62	Gisele F Gauze	1	6	1	2
62	Dariusz W Szczepanik	1	15	1	3
62	Wagner Richter	1	6	1	2
62	Luis R Domingo	1	9	7	10
62	Silvia S Jurisson	1	11	1	2
62	Xavier Solans-Monfort	1	21	2	3
62	Syed Ali Raza Naqvi	1	138	1	1
62	Xiaohong Zheng	1	17	2	3
62	Kamalika Ghatak	1	12	1	2
62	Haider Abbas	1	9	1	2
62	Liu-Ming Yan	1	2	2	2
62	Xiao-Fang Chen	1	5	1	1
62	Jinping Li	1	11	2	4
62	Andrew L Cooksy	1	7	1	3
62	Reza Ghafouri	1	6	2	8
62	Mohammednoor K Altarawneh	1	15	1	2
62	Giorgos Fagas	1	4	1	5
62	Titus Adrian Beu	1	4	1	2
62	Wei-Peng Lai	1	5	1	1
62	Yu-Zhi Song	1	138	1	1
62	Célia Fonseca Guerra	1	32	1	3
62	Hua-Qing Yang	1	16	1	1
62	Mao-Xia He	1	18	2	2
62	Jose Manuel Recio	1	41	1	2
62	Likai Du	1	9	1	3
62	Guo-Qun Liu	1	13	1	1
62	Maryam Anafcheh	1	6	2	8
62	Guillermo Ramirez-Galicia	1	0	1	3
62	Martín Regueiro-Figueroa	1	54	1	1
62	Jose Carneiro	1	2	2	8
62	Michael Badawi	1	25	1	1
62	David J Wales	1	20	2	7
62	Petr Vaňura	1	10	3	4
62	Sonia Ilieva	1	24	2	1
62	Bin Song	1	14	1	4
62	Shuwei Tang	1	1	1	3
62	Zhenhua Yang	1	20	1	4
62	Xiang Zhu	1	3	1	12
62	Chang-Wei Hu	1	16	5	9
62	Ajay Chaudhari	1	6	4	7
62	Ning Zhao	1	14	1	3
62	Yong Du	1	33	9	8
62	Joseba Iñai Juaristi	1	28	2	5
62	Denis Jacquemin	1	11	7	15
62	Brendan Kelly	1	12	1	1
62	Weizhou Wang	1	2	1	9
62	John C Mauro	1	10	3	6
62	Muhammad Ramzan Saeed Ashraf Janjua	1	138	1	2
62	Huilong Dong	1	13	1	2
62	Andrea Alparone	1	20	3	1
62	Elvira Guardia	1	11	2	3
62	Luiza Buimaga-Iarinca	1	10	1	2
62	Boris Galabov	1	24	1	1
62	Ruifa Jin	1	23	1	1
62	Andrzej Eilmes	1	5	1	2
62	Majdi Hochlaf	1	9	2	6
62	Mrinalini D Deshpande	1	12	1	1
62	Alexander V Nemukhin	1	8	1	7
62	Zhaoxu Wang	1	22	1	1
62	Debasish Koner	1	17	1	1
62	Amedeo Capobianco	1	47	1	2
62	Youyong Li	1	13	6	12
62	Wen-Liang Wang	1	11	1	3
62	Luís Pinto da Silva	1	11	3	7
62	Ilya I Marochkin	1	30	1	1
62	Gerardine G Botte	1	33	2	5
62	Sean C Smith	1	9	4	11
62	Zargham Bagheri	1	73	6	8
62	Paul S Bagus	1	33	2	6
62	Antonio Bauzá	1	7	4	8
62	Pradip K Bhattacharyya	1	3	1	2
62	Gabriele Saleh	1	164	1	2
62	Emilio L Angelina	1	24	1	2
62	María J Aurell	1	9	1	4
62	Oriana Brea	1	1	1	2
62	Thomas S Hofer	1	23	2	4
62	Mateusz Marianski	1	6	2	4
62	Andrej Perdih	1	14	1	5
62	Jakub Pšenčík	1	15	1	2
62	Isabel Rozas	1	12	1	3
62	Shigenori Tanaka	1	10	1	2
62	Alexander V Tulub	1	4	1	3
62	Ademir Neves	1	7	2	4
62	Damilola A Daramola	1	33	1	1
62	Denis Sh Sabirov	1	23	2	2
62	Carlos Platas-Iglesias	1	54	3	5
62	Di Wu	1	6	1	8
62	Aditya N Panda	1	17	1	2
62	Bernard Delley	1	36	1	1
62	Xiaoming Huang	1	45	3	3
62	Wei Chu	1	55	4	7
62	Emildo Marcano	1	24	1	1
62	Kazuyoshi Ueda	1	13	1	3
62	Zhengyuan Tu	1	1	1	1
62	Jan Cz Dobrowolski	1	11	2	6
62	Akira Nakayama	1	7	1	2
62	Olga V Dorofeeva	1	30	1	1
62	Lin Ji	1	1	1	2
62	Matheus P Freitas	1	5	2	13
62	Min-Quan Kuang	1	6	3	3
62	Petri Tähtinen	1	3	1	4
62	Mesfin Tsige	1	37	2	2
62	Ravi Joshi	1	1	1	4
62	Samuel Genheden	1	30	2	6
62	Prasanta K Nandi	1	26	1	1
62	Hirotoshi Mori	1	21	1	2
62	Sinisa Vukovic	1	15	1	3
62	Ricardo Inostroza-Rivera	1	4	1	1
62	Andrea Lombardi	1	47	1	2
62	Zhifei Zhang	1	10	1	1
62	Yu-Ling Song	1	12	1	1
62	Oleg A Filippov	1	18	2	4
62	Motoyuki Shiga	1	10	1	4
62	Vahid Saheb	1	20	1	1
62	Amparo Asensio	1	6	1	3
62	Markus Schröder	1	18	1	1
62	Marcel Swart	1	32	2	3
62	Alessandra F Albernaz	1	47	1	1
62	Marlies Hankel	1	9	1	3
62	Jose C Corchado	1	15	1	3
62	Peter Politzer	1	333	2	2
62	Shinkoh Nanbu	1	9	2	4
62	Joanne E Stubbs	1	25	1	2
62	Pablo Gamallo	1	17	3	4
62	Van-Hung Hoang	1	4	1	1
62	Ali Morsali	1	16	1	1
62	Futing Xia	1	5	1	1
62	Alice R Walker	1	11	1	1
62	Rita Kakkar	1	23	1	1
62	Domingo Madrigal	1	7	1	1
62	Janusz Madaj	1	8	1	2
62	Tony Ford	1	17	2	2
62	Julia Contreras-Garcia	1	41	3	5
62	William J Weber	1	23	6	9
62	Bao-Jun Wang	1	25	2	5
62	Francisco Nunez-Zarur	1	21	1	2
62	Chenghua Zhang	1	8	1	1
62	Diana V Cheshmedzhieva	1	24	2	1
62	Florent Louis	1	25	2	1
62	Panwang Zhou	1	6	1	3
62	Hiroshi Tatewaki	1	6	1	1
62	Yuto Komeiji	1	21	1	2
62	Andres Cedillo	1	11	2	1
62	Patricio F Provasi	1	14	1	2
62	Morteza Vahedpour	1	4	2	2
62	Yifang Ouyang	1	33	2	1
62	Maciej Bobrowski	1	2	1	2
62	Benjamin Lasorne	1	18	2	2
62	Xun-Lei Ding	1	22	2	11
62	Zulfiqar Ali Khan	1	138	2	1
62	Tomás González-Lezana	1	10	3	5
62	Roman Tuma	1	15	1	3
62	Ji Jun Xiao	1	57	1	1
62	Małgorzata Domagała	1	40	1	1
62	Ala'a H Al-Muhtaseb	1	15	2	5
62	Mariona Sodupe	1	21	2	4
62	Celine Leonard	1	1	1	7
62	Alfonso Hernández-Laguna	1	21	1	1
62	Marcos Antonio Loroño González	1	1	2	2
62	Jessica M Rimsza	1	52	1	1
62	Monica Calatayud	1	41	2	2
62	Hendrik G. Kruger	1	8	4	14
62	Steve Scheiner	1	32	2	4
62	Manuel Yanez	1	33	2	3
62	Sanjit Dey	1	14	1	1
62	Ming-Qiang Huang	1	10	2	2
62	Thishana Singh	1	8	1	1
62	Lorenza Operti	1	6	1	2
62	Sergei N Adamovich	1	36	3	1
62	Sylvain Picaud	1	18	1	3
62	Yang Xiao	1	9	1	2
62	Hans-Dieter Meyer	1	18	3	5
62	Bella L Grigorenko	1	8	1	4
62	Hiroshi Takeuchi	1	10	1	2
62	Takatoshi Fujita	1	10	1	2
62	Sara E Mason	1	24	1	2
62	Jianzhong Chen	1	13	2	2
62	Ricardo Faccio	1	18	2	4
62	Ze-Rong Li	1	13	1	2
62	Javad Beheshtian	1	73	5	10
62	Valeria Pittala	1	17	1	3
62	Cosimo Gianluca Fortuna	1	17	2	2
62	Muhammad Usman Khan	1	138	1	1
62	Bárbara Herrera	1	4	1	2
62	Mohammad Taghi Baei	1	70	8	6
62	Domingo Dominguez	1	3	1	1
62	Xiang-Yuan Li	1	13	3	4
62	David López-Durán	1	10	1	2
62	Marco Masia	1	11	1	2
62	Jun Li	1	13	3	5
62	Huiyong Wang	1	9	2	11
62	Walter C Ermler	1	4	1	1
62	Ajay Misra	1	15	1	4
62	Emanuel Makrlík	1	10	4	4
62	Otilia Mo Romero	1	33	2	3
62	Yunxiang Lu	1	3	1	8
62	Changyong Qin	1	17	1	1
62	Patrick Bultinck	1	15	3	6
62	Jan Alster	1	15	1	1
62	Ning Zhang	1	45	1	2
62	Marco Sacchi	1	20	2	2
62	Agnieszka Brzyska	1	5	1	1
62	Mikko Metsä-Ketelä	1	3	2	9
62	Estela Blaisten-Barojas	1	9	1	1
62	Shridhar P Gejji	1	5	1	4
62	Yanwei Li	1	9	1	1
62	Mohamad Zaman Kassaee	1	16	1	2
62	Alessandro Giuffrida	1	17	1	2
62	Silvia Brandán	1	12	1	3
62	Xuejing Liu	1	13	1	1
62	Robert Wieczorek	1	6	1	1
62	Pablo A Denis	1	18	1	4
62	Shigeyoshi Yamamoto	1	6	1	1
62	Claude Pouchan	1	12	2	5
62	Van-Hoang Le	1	4	1	2
62	Agnie Kosmas	1	13	1	1
62	Sławomir J Grabowski	1	11	1	2
62	L Senthilkumar	1	27	1	2
62	Xavier Assfeld	1	55	3	1
62	Armando Navarro-Vázquez	1	3	3	5
62	Kurtis M Carsch	1	12	1	1
62	Subhi Baishya	1	11	1	1
62	Xueqiang Qi	1	23	1	5
62	Oriol Vendrell	1	18	1	3
62	Friedrich Matthias Bickelhaupt	1	32	2	6
62	Pablo Villarreal	1	10	3	4
62	Ibrahem Altarawneh	1	15	1	1
62	Krishna Bisetty	1	8	1	4
62	Prodeep Phukan	1	19	4	5
62	Stephan P A Sauer	1	14	3	4
62	Stefano Borocci	1	6	1	1
62	Sílvia Simon Rabasseda	1	24	1	1
62	Luis Rodriguez-Santiago	1	21	1	2
62	Peter J Eng	1	25	1	1
62	Jane S Murray	1	333	1	2
62	Tahir Cagin	1	14	2	2
62	Thibaut Very	1	55	1	1
62	Jean-Louis Rivail	1	55	1	1
62	Kaushik Hatua	1	26	1	1
62	Konstantinos Gkionis	1	20	1	1
62	Alireza Salimi Beni	1	19	1	1
62	Matthias Schaller	1	5	1	1
62	Anoop Kumar Pandey	1	11	2	3
62	Joanna Sadlej	1	4	2	5
62	Emilio Squitieri	1	24	1	1
62	David S Perry	1	37	1	1
62	Fariba Mollania	1	34	1	2
62	Thomas P Trainor	1	24	1	3
62	Yeneneh Y Yimer	1	37	2	1
62	Alfred Karpfen	1	9	1	1
62	Heidar Raissi	1	35	2	2
62	Bernd M Rode	1	23	3	4
62	Jaafar Jalilian	1	12	1	1
62	Federico Iribarne	1	18	1	4
62	Snehasis Banerjee	1	14	1	1
62	Anubha Srivastava	1	41	1	1
62	Gotthard Seifert	1	120	2	3

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