Lauren Wickstrom
Broad Institute(US)
Publications by Year
Research Areas
Protein Structure and Dynamics, Spectroscopy and Quantum Chemical Studies, DNA and Nucleic Acid Chemistry, HIV/AIDS drug development and treatment, Computational Drug Discovery Methods
Most-Cited Works
- → ff14SB: Improving the Accuracy of Protein Side Chain and Backbone Parameters from ff99SB(2015)10,733 cited
- → Evaluating the Performance of the ff99SB Force Field Based on NMR Scalar Coupling Data(2009)210 cited
- → Improved Efficiency of Replica Exchange Simulations through Use of a Hybrid Explicit/Implicit Solvation Model(2006)148 cited
- → Secondary Structure Bias in Generalized Born Solvent Models: Comparison of Conformational Ensembles and Free Energy of Solvent Polarization from Explicit and Implicit Solvation(2007)133 cited
- → Large Scale Affinity Calculations of Cyclodextrin Host–Guest Complexes: Understanding the Role of Reorganization in the Molecular Recognition Process(2013)92 cited
- → Distinguishing Binders from False Positives by Free Energy Calculations: Fragment Screening Against the Flap Site of HIV Protease(2014)82 cited
- → Virtual screening of integrase inhibitors by large scale binding free energy calculations: the SAMPL4 challenge(2014)59 cited
- → The Unfolded State of the Villin Headpiece Helical Subdomain: Computational Studies of the Role of Locally Stabilized Structure(2006)47 cited
- → Enthalpic Breakdown of Water Structure on Protein Active-Site Surfaces(2016)43 cited
- → Resolving the Ligand-Binding Specificity in c-MYC G-Quadruplex DNA: Absolute Binding Free Energy Calculations and SPR Experiment(2017)42 cited