Comparative Molecular Dynamics Simulation Studies of Realistic Eukaryotic, Prokaryotic, and Archaeal Membranes.

Autor: Pogozheva ID; Department of Medicinal Chemistry, College of Pharmacy, University of Michigan, Ann Arbor, Michigan 48109, United States., Armstrong GA; Department of Biological Sciences, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Kong L; Department of Bioengineering, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Hartnagel TJ; Department of Chemistry, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Carpino CA; Department of Bioengineering, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Gee SE; Department of Bioengineering, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Picarello DM; Department of Biological Sciences, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Rubin AS; Department of Bioengineering, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Lee J; Department of Biological Sciences, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Park S; Department of Biological Sciences, Lehigh University, Bethlehem, Pennsylvania 18015, United States., Lomize AL; Department of Medicinal Chemistry, College of Pharmacy, University of Michigan, Ann Arbor, Michigan 48109, United States., Im W; Department of Biological Sciences, Lehigh University, Bethlehem, Pennsylvania 18015, United States.; Department of Bioengineering, Lehigh University, Bethlehem, Pennsylvania 18015, United States.; Department of Chemistry, Lehigh University, Bethlehem, Pennsylvania 18015, United States.

Publikováno v: Journal of chemical information and modeling [J Chem Inf Model] 2022 Feb 28; Vol. 62 (4), pp. 1036-1051. Date of Electronic Publication: 2022 Feb 15.