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Signatures of Quantum Interference in the Time Dependence of Charge Transfer in Donor–Bridge–Acceptor Molecules.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 741, doi. 10.1142/S2737416521500459
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- Article
Theoretical Investigation of Excited-State Intramolecular Double-Proton Transfer Mechanism of Substituent Modified 1, 3-Bis (2-Pyridylimino)-4,7-Dihydroxyisoindole in Dichloromethane Solution.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 707, doi. 10.1142/S2737416521500423
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- Article
Elucidation of Conformational Dynamics of MDM2 and Alterations Induced Upon Inhibitor Binding Using Elastic Network Simulations and Molecular Docking.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 751, doi. 10.1142/S2737416521500460
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- Article
Identification of Hotspot Residues in Binding of SARS-CoV-2 Spike and Human ACE2 Proteins.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 729, doi. 10.1142/S2737416521500447
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- Article
Designing rt-PA Analogs to Release its Trapped Thrombolytic Activity.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 719, doi. 10.1142/S2737416521500435
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- Article
Designing and Encapsulation of Inorganic Al12N12 Nanoclusters with Be, Mg, and Ca Metals for Efficient Hydrogen Adsorption: A Step Forward Towards Hydrogen Storage Materials.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 687, doi. 10.1142/S2737416521500411
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- Article
Adenine Quadruplexes Show Surprising Stability: Potential Implications for SARS-CoV-2.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 675, doi. 10.1142/S273741652150040X
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- Article
In Silico Approaches for Novel Drug Discovery Against Coronavirus by Employing the Hybrid Molecular Technique: A Review.
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- Journal of Computational Biophysics & Chemistry, 2021, v. 20, n. 7, p. 667, doi. 10.1142/S2737416521300017
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- Article