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Publications by Kira A. Armacost
Adaptive Landscape Flattening Accelerates Sampling of Alchemical Space in Multisite Λ Dynamics
Journal of Physical Chemistry B
Surfaces
Theoretical Chemistry
Materials Chemistry
Films
Medicine
Coatings
Physical
Parametrization of Halogen Bonds in the CHARMM General Force Field: Improved Treatment of Ligand–protein Interactions
Bioorganic and Medicinal Chemistry
Organic Chemistry
Molecular Medicine
Molecular Biology
Biochemistry
Clinical Biochemistry
Pharmaceutical Science
Drug Discovery
Related publications
Multisite Λ Dynamics for Simulated Structure–Activity Relationship Studies
Journal of Chemical Theory and Computation
Theoretical Chemistry
Computer Science Applications
Physical
Adaptive Sampling With Varying Sampling Cost for Design Space Exploration
AIAA Journal
Aerospace Engineering
Approaching Protein Design With Multisite Λ Dynamics: Accurate and Scalable Mutational Folding Free Energies in T4 Lysozyme
Protein Science
Biochemistry
Medicine
Molecular Biology
Λ-Statistical Convergence in Paranormed Space
Abstract and Applied Analysis
Applied Mathematics
Analysis
Λ-Ib-Sets in Topological Space
International Journal of Scientific Research in Science and Technology
Adaptive Landscape by Environment Interactions Dictate Evolutionary Dynamics in Models of Drug Resistance
PLoS Computational Biology
Molecular Neuroscience
Evolution
Ecology
Genetics
Behavior
Molecular Biology
Systematics
Simulation
Cellular
Computational Theory
Mathematics
Modeling
Detection of Intratumor Heterogeneity in Modern Pathology: A Multisite Tumor Sampling Perspective
Frontiers in Medicine
Medicine
Adaptive Sampling in Behavioral Surveys
Introducing Sampling Entropy in Repository Based Adaptive Umbrella Sampling
Journal of Chemical Physics
Medicine
Theoretical Chemistry
Astronomy
Physics
Physical
