Olexandr Isayev - Publications, H-index & Citations

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Olexandr Isayev

carnegie mellon university

55H-index

274Paper Count

1.8WCitation Count

Published Papers 71

Publication Date

Journal of Chemical Theory and Computation

IF5.5

2026-04-23

OAAI

Rommie E. Amaro; Victor Batista; Jochen Blumberger; Yee Siew Choong; Clémence Corminboeuf; Zoe Cournia; Qiang Cui; Marco De Vivo; Francesco A. Evangelista; Yi Qin Gao; Debashree Ghosh; Xiao He; Olexandr Isayev; Syma Khalid; Johannes Kirchmair; John R. Kitchin; Haiyan Liu; Kevin J. Naidoo; Duc Nguyen; Ariane Nunes Alves; Giulia Palermo; Brett Savoie; Thereza A. Soares; Pratyush Tiwary; Guowei Wei; Xiao Zheng; Tong Zhu; Kenneth M. Merz Jr.; Laura Gagliardi

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Journal of Chemical Theory and Computation

IF5.5

2026-02-14

PREAI

Yuxinxin Chen; Yi-Fan Hou; Roman Zubatyuk; Olexandr Isayev; Pavlo O. Dral

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Nature Computational Science

IF18.3

2025-12-22

PREAI

Bhupalee Kalita; Hatice Gokcan; Olexandr Isayev

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Angewandte Chemie International Edition

IF16.9

2025-12-16

OAAI

Dr. Bhupalee Kalita; Dr. Roman Zubatyuk; Dr. Dylan M. Anstine; Dr. Maike Bergeler; Dr. Volker Settels; Dr. Conrad Stork; Dr. Sebastian Spicher; Dr. Olexandr Isayev

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Digital Discovery

IF5.6

2025-10-29

OAAI

Filipp Gusev; Benjamin C Kline; Ryan Quinn; Anqin Xu; Ben Smith; Brian Frezza; Olexandr Isayev

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Nature Communications

IF15.7

2025-10-17

OAAI

Roman Zubatyuk; Malgorzata Biczysko; Kavindri Ranasinghe; Nigel W. Moriarty; Hatice Gokcan; Holger Kruse; Billy K. Poon; Paul D. Adams; Mark P. Waller; Adrian E. Roitberg; Olexandr Isayev; Pavel V. Afonine

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Crystal Growth & Design

IF3.4

2025-10-14

OAAI

Kamal Singh Nayal; Dana O’Connor; Roman Zubatyuk; Dylan M. Anstine; Yi Yang; Rithwik Tom; Wenda Deng; Kehan Tang; Noa Marom; Olexandr Isayev

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JACS Au

IF8.7

2025-10-13

OAAI

Zhen Liu; Jessica Vinskus; Yue Fu; Peng Liu; Kevin J. T. Noonan; Olexandr Isayev

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Journal of Chemical Theory and Computation

IF5.5

2025-10-09

PREAI

Nicholas Casetti; Dylan Anstine; Olexandr Isayev; Connor W. Coley

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Digital Discovery

IF5.6

2025-10-03

OAAI

Filipp Nikitin; Ian Dunn; David Ryan Koes; Olexandr Isayev

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Chem. Sci.

IF7.4

2025-10-03

OAAI

Peikun Zheng; Olexandr Isayev

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Journal of Chemical Information and Modeling

IF5.3

2025-09-03

OAAI

Polina Avdiunina; Shamieraah Jamal; Filipp Gusev; Olexandr Isayev

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JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2024-11-05

OAAI

Li, Fengling; Ackloo, Suzanne; Arrowsmith, Cheryl H.; Ban, Fuqiang; Barden, Christopher J.; Beck, Hartmut; Beranek, Jan; Berenger, Francois; Bolotokova, Albina; Bret, Guillaume; Breznik, Marko; Carosati, Emanuele; Chau, Irene; Chen, Yu; Cherkasov, Artem; Della Corte, Dennis; Denzinger, Katrin; Dong, Aiping; Draga, Sorin; Dunn, Ian; Edfeldt, Kristina; Edwards, Aled; Eguida, Merveille; Eisenhuth, Paul; Friedrich, Lukas; Fuerll, Alexander; Gardiner, Spencer S.; Gentile, Francesco; Ghiabi, Pegah; Gibson, Elisa; Glavatskikh, Marta; Gorgulla, Christoph; Guenther, Judith; Gunnarsson, Anders; Gusev, Filipp; Gutkin, Evgeny; Halabelian, Levon; Harding, Rachel J.; Hillisch, Alexander; Hoffer, Laurent; Hogner, Anders; Houliston, Scott; Irwin, John J.; Isayev, Olexandr; Ivanova, Aleksandra; Jacquemard, Celien; Jarrett, Austin J.; Jensen, Jan H.; Kireev, Dmitri; Kleber, Julian; Koby, S. Benjamin; Koes, David; Kumar, Ashutosh; Kurnikova, Maria G.; Kutlushina, Alina; Lessel, Uta; Liessmann, Fabian; Liu, Sijie; Lu, Wei; Meiler, Jens; Mettu, Akhila; Minibaeva, Guzel; Moretti, Rocco; Morris, Connor J.; Narangoda, Chamali; Noonan, Theresa; Obendorf, Leon; Pach, Szymon; Pandit, Amit; Perveen, Sumera; Poda, Gennady; Polishchuk, Pavel; Puls, Kristina; Puetter, Vera; Rognan, Didier; Roskams-Edris, Dylan; Schindler, Christina; Sindt, Francois; Spiwok, Vojtech; Steinmann, Casper; Stevens, Rick L.; Talagayev, Valerij; Tingey, Damon; Vu, Oanh; Walters, W. Patrick; Wang, Xiaowen; Wang, Zhenyu; Wolber, Gerhard; Wolf, Clemens Alexander; Wortmann, Lars; Zeng, Hong; Zepeda, Carlos A.; Zhang, Kam Y. J.; Zhang, Jixian; Zheng, Shuangjia; Schapira, Matthieu

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JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-10-01

PREAI

Haghiri, Shahed; Rojas, Claudia Viquez; Bhat, Sriram; Isayev, Olexandr; Slipchenko, Lyudmila

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JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2024-07-25

OAAI

Johnson, Holly M.; Gusev, Filipp; Dull, Jordan T.; Seo, Yejoon; Priestley, Rodney D.; Isayev, Olexandr; Rand, Barry P.

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ANNUAL REVIEW OF PHYSICAL CHEMISTRY

IF11.7

2024-06-28

PREAI

Yang, Yinuo; Zhang, Shuhao; Ranasinghe, Kavindri D.; Isayev, Olexandr; Roitberg, Adrian E.

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JOURNAL OF CHEMICAL INFORMATION AND MODELING

IF5.3

2024-05-27

OAAI

Merz, Kenneth M.; Choong, Yee Siew; Cournia, Zoe; Isayev, Olexandr; Soares, Thereza A.; Wei, Guo-Wei; Zhu, Feng

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NATURE CHEMISTRY

IF20.2

2024-03-07

OAAI

Zhang, Shuhao; Makos, Malgorzata Z.; Jadrich, Ryan B.; Kraka, Elfi; Barros, Kipton; Nebgen, Benjamin T.; Tretiak, Sergei; Isayev, Olexandr; Lubbers, Nicholas; Messerly, Richard A.; Smith, Justin S.

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JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-01-25

OAAI

Dral, Pavlo O.; Ge, Fuchun; Hou, Yi-Fan; Zheng, Peikun; Chen, Yuxinxin; Barbatti, Mario; Isayev, Olexandr; Wang, Cheng; Xue, Bao-Xin; Pinheiro Jr, Max; Su, Yuming; Dai, Yiheng; Chen, Yangtao; Zhang, Lina; Zhang, Shuang; Ullah, Arif; Zhang, Quanhao; Ou, Yanchi

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CHEMICAL SCIENCE

IF7.4

2024-01-01

OAAI

Gutkin, Evgeny; Gusev, Filipp; Gentile, Francesco; Ban, Fuqiang; Koby, S. Benjamin; Narangoda, Chamali; Isayev, Olexandr; Cherkasov, Artem; Kurnikova, Maria G.

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Research Directions