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Page 1
Theory: general discussion.
Anand M, Baletto F, Bugaev A, Catlow R, Claeys M, Conway M, Davidson M, Davies P, de Leeuw N, Eremin D, Fischer N, Hargreaves J, Hutchings G, Iyer J, Jain D, Jameel F, Kamali AR, Kondrat S, Kowalec I, Kraus P, Reece C, Réocreux R, Santos-Carballal D, Seavill PW, Shozi M, Sinev M, Sinha V, Stamatakis M, Uner D, Vojvodic A, Whiston K, Willock D, Wolf M, Yang B, Zhu B. Anand M, et al. Among authors: eremin d. Faraday Discuss. 2021 May 1;229:131-160. doi: 10.1039/d1fd90030g. Epub 2021 May 19. Faraday Discuss. 2021. PMID: 34008631 No abstract available.
Virtual Screening of a Chemically Diverse "Superscaffold" Library Enables Ligand Discovery for a Key GPCR Target.
Grotsch K, Sadybekov AV, Hiller S, Zaidi S, Eremin D, Le A, Liu Y, Smith EC, Illiopoulis-Tsoutsouvas C, Thomas J, Aggarwal S, Pickett JE, Reyes C, Picazo E, Roth BL, Makriyannis A, Katritch V, Fokin VV. Grotsch K, et al. Among authors: eremin d. ACS Chem Biol. 2024 Apr 19;19(4):866-874. doi: 10.1021/acschembio.3c00602. Epub 2024 Apr 10. ACS Chem Biol. 2024. PMID: 38598723 Free PMC article.
Dynamics: general discussion.
Ananikov V, Bugaev A, Chansai S, Claeys M, Conway M, Eremin D, Greaves M, Hess C, Hintermair U, Hutchings G, Jameel F, Kamali AR, Koehler K, Malkov A, Morgan P, Oyarzún Aravena AM, Seavill PW, Sinev M, Torrente Murciano L, Uner D, Whiston K, Williams CK, Wolf M. Ananikov V, et al. Among authors: eremin d. Faraday Discuss. 2021 May 1;229:489-501. doi: 10.1039/d1fd90031e. Epub 2021 May 19. Faraday Discuss. 2021. PMID: 34008656 No abstract available.
Advanced approaches: general discussion.
Anand M, Beale AM, Boronat M, Bowker M, Bugaev AL, Bukhtiyarov VI, Catlow CRA, Chansai S, Claeys M, Conway M, Davies PR, Edwards J, El-Kadi J, Eremin D, Fischer N, Guan S, Hargreaves JSJ, Hess C, Hutchings GJ, Jameel F, Reza Kamali A, Kondrat S, Lawes N, Lennon D, Li D, Morgan P, Oyarzún Aravena AM, Reece C, Réocreux R, Seavill PW, Sekine Y, Shozi M, Silverwood I, Sinev M, Smith C, Stamatakis M, Torrente Murciano L, Uner D, Weckhuysen BM, Whiston K, Wolf M, Yang B, Zeinalipour-Yazdi CD. Anand M, et al. Among authors: eremin d. Faraday Discuss. 2021 May 1;229:378-421. doi: 10.1039/d1fd90032c. Epub 2021 May 19. Faraday Discuss. 2021. PMID: 34008684 No abstract available.
Calibrating the Oxidative Capacity of Microdroplets.
Majumder T, Eremin DB, Delibas B, Sarkar A, Fokin V, Dawlaty JM. Majumder T, et al. Among authors: eremin db. Angew Chem Int Ed Engl. 2025 Jan 10;64(2):e202414746. doi: 10.1002/anie.202414746. Epub 2024 Oct 30. Angew Chem Int Ed Engl. 2025. PMID: 39218788
Visualizing partial solvation at the air-water interface.
Judd KD, Parsons SW, Eremin DB, Fokin VV, Dawlaty JM. Judd KD, et al. Among authors: eremin db. Chem Sci. 2024 Apr 24;15(22):8346-8354. doi: 10.1039/d4sc01311e. eCollection 2024 Jun 5. Chem Sci. 2024. PMID: 38846382 Free PMC article.
40 results