George Seibel

AMBER, a package of computer programs for applying molecular mechanics, normal mode analysis, molecular dynamics and free energy calculations to simulate the structural and energetic properties of molecules

David A. Pearlman, David A. Case, James W. Caldwell et al. · Computer Physics Communications · 1995 · 3.1K citations

Engineering, Normal Mode Analysis, Natural Sciences +13

Pyridinyl Imidazole Inhibitors of p38 Mitogen-activated Protein Kinase Bind in the ATP Site

Peter R. Young, Megan M. McLaughlin, Sanjay Kumar et al. · Journal of Biological Chemistry · 1997 · 573 citations · Full text

Using shape complementarity as an initial screen in designing ligands for a receptor binding site of known three-dimensional structure

Renée L. DesJarlais, Robert P. Sheridan, George Seibel et al. · Journal of Medicinal Chemistry · 1988 · 404 citations

Structure-based design of nonpeptide inhibitors specific for the human immunodeficiency virus 1 protease.

Renée L. DesJarlais, George Seibel, Irwin D. Kuntz et al. · Proceedings of the National Academy of Sciences · 1990 · 254 citations · Full text

Crystal Structure, Molecular Biology, Antiviral Drug +18

Regulation of stress-induced cytokine production by pyridinylimidazoles; inhibition of CSBP kinase

Timothy F. Gallagher, George Seibel, Shouki Kassis et al. · Bioorganic & Medicinal Chemistry · 1997 · 218 citations

Inflammation, Cytokine, Reductive Stress +15