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Computational Methods for NMR Structural Biology and Biomanufacturing of Protein and Live Cell Therapeutics NIST only participates in the February and August reviews. Protein therapeutics
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of the constraints on sequencing (read length, depth), and informatics (e.g., database composition, algorithm biases). Proposals should address these challenges with strategies to evaluate the metagenomic
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NIST only participates in the February and August reviews. Computer-based tools, including the NIST Alternatives for Resilient Communities model, or NIST ARC, are being developed to support
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the development towards this end of efficient, highly parallel software running on commodity hardware. Novel methods to compute the stray field from magnetized material with attention to interface and
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. This computational approach, incorporating quantum mechanics, can help materials research by a) directly simulating and interpreting experiments, b) establishing relationships between material structure and properties
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jessica.reiner@nist.gov 843.460.9894 Description The Analytical Chemistry Division has an ongoing program to improve the quality of analytical chemical measurements made in marine environmental research through
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301.975.8582 Michael Garth Huber michael.huber@nist.gov 301 975 5641 Description This program explores complementary aspects of atom and neutron interferometry with particular emphasis on their interplay with
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understanding of the physics of the QAHE necessary to design and develop new quantum resistance standards. Additional applications in quantum information science (QIS) can be envisioned for robust QAHE devices
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these models do not account for realistic conditions and require lengthy computational time. In order to overcome the practical challenges and numerical bottlenecks, the Fire Research Division of NIST’s
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also difficult; currently available wavefunction diagnostics are not yet reliable for this purpose and partition functions include uncontrolled approximations. key words Ab initio; Computational