Resveratrol serves as a protein-substrate interaction stabilizer in human SIRT1 activation

Xuben Hou, David Rooklin, Hao Fang, +1

Scientific Reports

Molecular BiologyOxidative StressMetabolic SignalingCell SignalingMolecular Signaling +20

AlphaSpace: Fragment-Centric Topographical Mapping To Target Protein–Protein Interaction Interfaces

David Rooklin, Cheng Wang, Joseph Katigbak, +2

Journal of Chemical Information and Modeling

Fragment-centric Topographical MappingProtein AssemblyInteractomicsProtein FoldingMedicine +13

σ Bonds: Electronic structure, photophysics, and photochemistry of oligosilanes

Heather A. Fogarty, Deborah L. Casher, Roman Imhof, +3

Pure and Applied Chemistry

EngineeringPhotochemistryσ BondsElectronic StatesChain Length +10

Targeting Unoccupied Surfaces on Protein–Protein Interfaces

David Rooklin, Ashley E. Modell, Haotian Li, +3

Journal of the American Chemical Society

Modulation of virus-induced NF-κB signaling by NEMO coiled coil mimics

Jouliana Sadek, Michael Wuo, David Rooklin, +7

Nature Communications

Viral ReplicationPrimary Effusion LymphomaViral PathogenesisImmunologyCancer Biology +17

Revelation of a Catalytic Calcium-Binding Site Elucidates Unusual Metal Dependence of a Human Apyrase

David Rooklin, Min Lu, Yingkai Zhang

Journal of the American Chemical Society

Time-dependent density functional theory treatment of the first UV absorption band in all-transoid permethyloligosilanes SinMe2n+2 (n = 2-8, 10)

David Rooklin, Thorsten Schepers, Mary K. Raymond-Johansson, +1

Photochemical & Photobiological Sciences

PhotochemistryUv-vis SpectroscopyAll-transoid Permethyloligosilanes Sinme2n+2Light AbsorptionChemistry +1

AlphaSpace 2.0: Representing Concave Biomolecular Surfaces Using β-Clusters

Joseph Katigbak, Haotian Li, David Rooklin, +1

Journal of Chemical Information and Modeling

Intuitive Understanding of σ Delocalization in Loose and σ Localization in Tight Helical Conformations of an Oligosilane Chain

Milena Jovanović, Dean Antic, David Rooklin, +2

Chemistry - An Asian Journal

Identification of Secondary Binding Sites on Protein Surfaces for Rational Elaboration of Synthetic Protein Mimics

Justin M. Torner, Yuwei Yang, David Rooklin, +2

ACS Chemical Biology