Mikael Peräkylä

25-Hydroxyvitamin D3 is an agonistic vitamin D receptor ligand

Yan‐Ru Lou, Ferdinand Molnár, Mikael Peräkylä et al. · The Journal of Steroid Biochemistry and Molecular Biology · 2009 · 154 citations

Molecular Pharmacology, Functional Selectivity, Pharmacology +3

New energy terms for reduced protein models implemented in an off‐lattice force field

Tommi Hassinen, Mikael Peräkylä · Journal of Computational Chemistry · 2001 · 137 citations

Biophysical Modeling, Protein Assembly, Reduced Protein Model +24

Elucidating the Nature of Enzyme Catalysis Utilizing a New Twist on an Old Methodology:  Quantum Mechanical−Free Energy Calculations on Chemical Reactions in Enzymes and in Aqueous Solution

Peter A. Kollman, Bernd Kuhn, Oreola Donini et al. · Accounts of Chemical Research · 2000 · 123 citations

Combined <i>ab initio </i>and Free Energy Calculations To Study Reactions in Enzymes and Solution:  Amide Hydrolysis in Trypsin and Aqueous Solution

Robert V. Stanton, Mikael Peräkylä, Dirk Bakowies et al. · Journal of the American Chemical Society · 1998 · 95 citations

<i>Ab Initio</i> Quantum Mechanical Study on the Origin of the p<i>K</i>_a Differences of the Proton Sponges 1,8-Bis(dimethylamino)naphthalene, 1,8-Bis(dimethylamino)-2,7-dimethoxynaphthalene, 1,6-Dimethyl-1,6-diazacyclodecane, and 1,6-Diazabicyclo[4.4.4]tetradecane

Mikael Peräkylä · The Journal of Organic Chemistry · 1996 · 88 citations

Engineering, Organic Chemistry, Computational Chemistry +16