Journal of Biomolecular Structure and Dynamics Effect of local anesthetic drug procaine hydrochloride on the conformational stability of bovine hemoglobin: Multi-spectroscopic and computational approaches. By Deepak Kaushal, 4 years ago
Journal of Biomolecular Structure and Dynamics A higher flexibility at the SARS-CoV-2 main protease active site compared to SARS-CoV and its potentialities for new inhibitor virtual screening targeting multi-conformers. By Rafael E. O. Rocha, 4 years ago
Journal of Biomolecular Structure and Dynamics Design, synthesis, structural and molecular characterization, toxicity, psychotropic activity and molecular docking evaluation of a novel phenytoin derivative: 3-decyl-5,5-diphenylimidazolidine-2,4-dione. By Walid Guerrab, 4 years ago
Journal of Biomolecular Structure and Dynamics Theoretical study of the vibrational properties of L-alanine and its zwitterionic form in the gas phase and in solution. By Myriam Rahmani, 4 years ago
Journal of Biomolecular Structure and Dynamics Medicinal plant compounds as promising inhibitors of coronavirus (COVID-19) main protease: an in silico study. By Navid Jamali, 4 years ago
Journal of Biomolecular Structure and Dynamics Computational investigation of phytochemicals from Withania somnifera (Indian ginseng/ashwagandha) as plausible inhibitors of GluN2B-containing NMDA receptors. By Iqrar Ahmad, 4 years ago
Journal of Biomolecular Structure and Dynamics Identifying and elucidating the roles of Y198N and Y204F mutations in the PAH enzyme through molecular dynamic simulations. By Tolga Aslan, 4 years ago
Journal of Biomolecular Structure and Dynamics Bingham deep neural and oppositional fish swarm optimized protein structure prediction. By Varanavasi Nallasamy, 4 years ago
Journal of Biomolecular Structure and Dynamics Structure, DFT studies and evaluation of catechol oxidase (CO) mimic activity of mononuclear Co(II) complexes derived from aminoalcohols: an experimental and theoretical approach. By Mantasha I., 4 years ago
Journal of Biomolecular Structure and Dynamics In-silico evidences on filarial cystatin as a putative ligand of human TLR4. By Nabarun Chandra Das, 4 years ago