Rasulev Research Group

Welcome to the Computational Polymer Science and Cheminformatics Group

New Publications

Summer undergraduate student Denys Vasyutyn created a short youtube Intro to QSAR

06 Nov 2023

Our 2023 Summer Research Undergraduate Program (REU Green Chemistry program) student Denys Vasyutyn (New York University, NY) created a nice short 5 minute video explaining what is QSAR and how QSAR is applied to predict…

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A collaborative paper published in Toxics

13 Jul 2023

Our team published a collaborative paper peer-reviewed journal Toxics with teams from Vietnam and Uzbekistan! Congratulations to Gerardo and all co-authors! The work is done in collaboration with the groups from Hanoi University of Pharmacy…

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A collaborative paper published recently in ACS Applied Polymer Materials

28 May 2022

Our collaborative paper is published in ACS Applied Polymer Materials! Congratulations to Anas and all co-authors! The work is done in collaboration with the group of Prof. Wenjie Xia (NDSU, Fargo) and Prof. Aniruddh Vashisth…

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Our group published a collaborative paper in ACS Applied Materials & Interfaces!

15 Apr 2022

Our collaborative paper is published in ACS Applied Materials & Interfaces (IF = 9.229)! Congratulations Kristen and all co-authors! The work is done in collaboration with the group of Prof. Andriy Voronov. Citation: Patnode K., Rasulev…

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Our group published a collaborative paper in Computational and Structural Biotechnology Journal!

14 Apr 2022

Our collaborative paper is published in Computational and Structural Biotechnology Journal (IF = 7.271)! Congratulations to all co-authors! The work is done in collaboration with the international group from Slovenia, Turkey and Italy. Thanks a…

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Our group published a collaborative paper in ACS Omega!

14 Apr 2022

Our collaborative paper is published in ACS Omega! Congratulations Anas and all co-authors! The work is done in collaboration with the international group from India, under supervision of Prof. P. Raghavan. Citation: Varghese G.P.J., David D.A.,…

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Our group published a collaborative paper in ACS Sustainable Chemistry & Engineering! Congratulations Kristen!

15 Jul 2021

Our collaborative paper is accepted to publication in ACS Sustainable Chemistry & Engineering (IF = 8.198)! Congratulations Kristen with your first publication! The work is done in collaboration with the group of Prof. Andriy Voronov….

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Prof. Rasulev is Guest Editing the Special Issue in journal Molecules (MDPI)

02 Apr 2021

Prof. Rasulev is Guest Editing a Special Issue “QSAR and QSPR: Recent Developments and Applications III” in journal Molecules (MDPI)

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Our group published a collaborative paper in Polymer!

03 Feb 2021

Congratulations to all co-authors (Anas K., Amir A. and Wenjie Xia) with our recently published paper in Polymer (IF=4.23)! Citation: Anas K., Amirhadi A., Xia W., Rasulev B. Predicting Glass Transition of Amorphous Polymers via Integration of…

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News

Rahil AshtariMahini has successfully defended her PhD in Computer Science on Apr 29, 2025

30 May 2025

I am happy to announce that Rahil AshtariMahini has successfully defended her PhD dissertation on April 29, 2025. The title of her thesis is “ADVANCING MIXTURE DESCRIPTORS AND MACHINE LEARNING ANALYSIS FOR MULTI-COMPONENT MATERIALS”. Thanks…

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Mariam Zamani has successfully defended her PhD thesis on April 11, 2025

15 Apr 2025

I am happy to announce that Mariam Zamani has successfully defended her PhD dissertation on April 11, 2025. The title of her thesis is “Application of Machine Learning-Driven QSAR Modeling for Diabetic Inhibitors”. Thanks to…

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Kweeni Iduoku has successfully defended his PhD dissertation on June 27, 2024

08 Sep 2024

I am proud to announce that Kweeni Iduoku, has successfully defended his PhD dissertation on June 27, 2024. The title of his thesis is “APPLICATIONS OF COMPUTATIONAL AND MACHINE LEARNING METHODS TO STUDY BIO-BASED AND…

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Achiya Khanam has successfully defended her MSc thesis on May 10, 2024

16 May 2024

I am proud to announce that Achiya Khanam (MSc student in my group), has successfully defended her MSc thesis on May 10, 2024. The title of her thesis is “Application of Quantitative Structure-Activity Relationship and…

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Meade Erickson is successfully defended his PhD dissertation on Oct 16, 2023

17 Oct 2023

I am proud to announce that Meade Erickson (Ph.D. student in my group), has successfully defended his PhD dissertation on October 16, 2023. The title of his thesis is “The Application and Development of Multi-Paradigm…

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Our students participated at ACS Spring 2023 Meeting

04 Apr 2023

Rasulev Group students Chameli Samarawickrema and Achiya Khanam participated at the ACS Spring 2023 Meeting. The meeting was held in Indianapolis, IN on March 26-30, 2023. They presented the following posters: 1. Chameli Samarawickrema, Anas…

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Our group is participated at 2023 ACS Red River Valley Conference!

29 Jan 2023

Rasulev group is participated at 2023 ACS Red River Valley Conference, which was organized by local ACS Division (Red Rived Valley Division), and held in Concordia College, Moorhead, MN on January 27-28, 2023. Eight students…

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Anas Karuth is successfully defended his PhD dissertation on Jan 18, 2023

21 Jan 2023

I am proud to announce that my Ph.D. student, Anas Karuth successfully defended his PhD dissertation on January 18, 223. The title of his thesis is “Integrated Machine Learning and Computational Framework for Predicting the…

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Our group’s PhD student, Anas, presented at ACS Meeting and received an award

15 Apr 2022

Our group’s PhD student, Anas Karuth, has been selected and presented his research at the “Excellence in Graduate Polymer Research Symposium” at ACS Meeting held in San Diego (Spring 2022), CA. At the end of…

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Awards

Our group received a prestigious DOE Award of $1.9M

11 Sep 2021

Our group just received a prestigious DOE Award from Department of Energy (DOE) to perform a combined computational, machine learning and experimental study of NIR materials! Congratulations to all collaborators! The team members are: Prof….

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Our group together with multidisciplinary team received a large NSF MRI $1.2M Award!

21 Jul 2020

Our group just received a prestigious NSF MRI Award from National Science Foundation together with a large multidisciplinary team at NDSU! Congratulations to all collaborators who is involved in this large multidisciplinary project – Dr….

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Our group received a prestigious NIH Award!

26 Jun 2020

Our group just received a prestigious R03 Award from National Institute of Health (NIH)! Congratulations to all collaborators! The team members are: Prof. Dali Sun (Electrical and Computer Engineering), Prof. Bakhtiyor Rasulev (CPM) and Prof….

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Our group received a competitive Carl A. & Jean Y. White Memorial Endowment Award!

15 Jun 2020

Our group received a competitive Carl A. & Jean Y. White Memorial Endowment Award from NDSU Foundation! This Award will allow the Rasulev group to continue working in the field of bio-based materials development from…

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Our group received a competitive ND EPSCoR Travel Award

15 Mar 2019

Our group received a competitive ND EPSCoR Tavel Award! This Travel Award will be used to travel to a partner group in another EPSCoR state. Two group members, Meade Erickson and Dr. Rasulev will visit…

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Our group just received a prestigious NSF Award!

12 Aug 2018

Our group just received a prestigious Award from National Science Foundation! Congratulations to all collaborators who is involved to this innovative project – Prof. Svetlana Kilina, Prof. Wenfang Sun and Prof. Dmitri Kilin! Project title: …

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