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Publications by Ray Luo
Reducing Grid Dependence in Finite-Difference Poisson–Boltzmann Calculations
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
Applications of MMPBSA to Membrane Proteins I: Efficient Numerical Solutions of Periodic Poisson–Boltzmann Equation
Journal of Chemical Information and Modeling
Computer Science Applications
Chemistry
Chemical Engineering
Library
Information Sciences
Crystal Structure of StnA for the Biosynthesis of Antitumor Drug Streptonigrin Reveals a Unique Substrate Binding Mode
Scientific Reports
Multidisciplinary
Allosteric Pathways in Tetrahydrofolate Sensing Riboswitch With Dynamics Correlation Network
Molecular BioSystems
Biotechnology
Molecular Biology
Development of Polarizable Models for Molecular Mechanical Calculations. 3. Polarizable Water Models Conforming to Thole Polarization Screening Schemes
Journal of Physical Chemistry B
Surfaces
Theoretical Chemistry
Materials Chemistry
Films
Medicine
Coatings
Physical
Development of Polarizable Models for Molecular Mechanical Calculations II: Induced Dipole Models Significantly Improve Accuracy of Intermolecular Interaction Energies
Journal of Physical Chemistry B
Surfaces
Theoretical Chemistry
Materials Chemistry
Films
Medicine
Coatings
Physical
Ff14IDPsforce Field Improving the Conformation Sampling of Intrinsically Disordered Proteins
Chemical Biology and Drug Design
Biochemistry
Organic Chemistry
Drug Discovery
Molecular Medicine
Pharmacology
Exploring Accurate Poisson–Boltzmann Methods for Biomolecular Simulations
Computational and Theoretical Chemistry
Biochemistry
Theoretical Chemistry
Condensed Matter Physics
Physical
Molecular Mechanisms of Functional Rescue Mediated by P53 Tumor Suppressor Mutations
Biophysical Chemistry
Organic Chemistry
Biochemistry
Biophysics
