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Simulating Chemistry on Bosonic Quantum Devices.
Dutta R, Cabral DGA, Lyu N, Vu NP, Wang Y, Allen B, Dan X, Cortiñas RG, Khazaei P, Schäfer M, Albornoz ACCD, Smart SE, Nie S, Devoret MH, Mazziotti DA, Narang P, Wang C, Whitfield JD, Wilson AK, Hendrickson HP, Lidar DA, Pérez-Bernal F, Santos LF, Kais S, Geva E, Batista VS. Dutta R, et al. Among authors: allen b. J Chem Theory Comput. 2024 Aug 13;20(15):6426-6441. doi: 10.1021/acs.jctc.4c00544. Epub 2024 Jul 28. J Chem Theory Comput. 2024. PMID: 39068594 Review.
Structural Basis for Reduced Dynamics of Three Engineered HNH Endonuclease Lys-to-Ala Mutants for the Clustered Regularly Interspaced Short Palindromic Repeat (CRISPR)-Associated 9 (CRISPR/Cas9) Enzyme.
Wang J, Skeens E, Arantes PR, Maschietto F, Allen B, Kyro GW, Lisi GP, Palermo G, Batista VS. Wang J, et al. Among authors: allen b. Biochemistry. 2022 May 3;61(9):785-794. doi: 10.1021/acs.biochem.2c00127. Epub 2022 Apr 14. Biochemistry. 2022. PMID: 35420793 Free PMC article.
Kernel-elastic autoencoder for molecular design.
Li H, Shee Y, Allen B, Maschietto F, Morgunov A, Batista V. Li H, et al. Among authors: allen b. PNAS Nexus. 2024 Apr 25;3(4):pgae168. doi: 10.1093/pnasnexus/pgae168. eCollection 2024 Apr. PNAS Nexus. 2024. PMID: 38689710 Free PMC article.
2,717 results