From NO to NTe: <i>In Silico</i> Study of Ruthenium Compounds Containing Chalcogenonitrosyl Ligands. [PDF]
Glitz V +3 more
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Implementation of Replica-Averaged Restraints from Nuclear Magnetic Resonance Measurement with UNRES Coarse Grained Model of Polypeptide Chains. [PDF]
Shirkov L, Czaplewski C, Liwo A.
europepmc +1 more source
Origin of Correlations between Local Conformational States of Consecutive Amino Acid Residues and Their Role in Shaping Protein Structures and in Allostery. [PDF]
Sikorska C, Liwo A.
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Hydrophobic and Electrostatic Sequence Patterning Directs Hierarchical Assembly of Phenylalanine-Rich Oligopeptides. [PDF]
Leśniewski M +5 more
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Giant Spin-flop magnetoresistance in a collinear antiferromagnetic tunnel junction. [PDF]
Xu S +25 more
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Integration of nested cross-validation, automated hyperparameter optimization, high-performance computing to reduce and quantify the variance of test performance estimation of deep learning models. [PDF]
Calle P +12 more
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How Useful can the Voigt Profile be in Protein Folding Processes? [PDF]
Maisuradze L, Maisuradze GG.
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Multiscale analysis of autotroph-heterotroph interactions in a high-temperature microbial community. [PDF]
Hunt KA +3 more
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Two Methods for Superposing the Structures of Like-Molecule Assemblies: Application to Peptide and Protein Oligomers and Aggregates. [PDF]
Liwo A, Leśniewski M.
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