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Unraveling the Role of Nanobodies Tetrad on Their Folding and Stability Assisted by Machine and Deep Learning Algorithms.

, , and . BSB, volume 12558 of Lecture Notes in Computer Science, page 93-104. Springer, (2020)

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Developing a Dynamic Pharmacophore Model for HIV-1 Integrase, , , , , , , and . Journal of Medicinal Chemistry, 43 (11): 2100-2114 (2000)PMID: 10841789.Extension and validation of the GROMOS 53A6glyc parameter set for glycoproteins., , and . J. Comput. Chem., 35 (29): 2087-2095 (2014)IMSPeptider: A computational peptide collision cross-section area calculator based on a novel molecular dynamics simulation protocol., , , and . J. Comput. Chem., 34 (20): 1707-1718 (2013)SuAVE: A Tool for Analyzing Curvature-Dependent Properties in Chemical Interfaces., , , , and . J. Chem. Inf. Model., 60 (2): 473-484 (2020)Polymyxin Binding to the Bacterial Outer Membrane Reveals Cation Displacement and Increasing Membrane Curvature in Susceptible but Not in Resistant Lipopolysaccharide Chemotypes., , , and . J. Chem. Inf. Model., 57 (9): 2181-2193 (September 2017)Rotational Profiler: A Fast, Automated, and Interactive Server to Derive Torsional Dihedral Potentials for Classical Molecular Simulations., , , , , , , and . J. Chem. Inf. Model., 60 (12): 5923-5927 (2020)A new GROMOS force field for hexopyranose-based carbohydrates., and . J. Comput. Chem., 26 (13): 1400-1412 (2005)Northwest Trajectory Analysis Capability: A Platform for Enhancing Biophysics Analysis., , , , , , , , , and 1 other author(s). BIOCOMP, page 558-562. CSREA Press, (2008)Influence of Scaffold Stability and Electrostatics on Top7-Based Engineered Helical HIV-1 Epitopes., , , , and . BSB, volume 8213 of Lecture Notes in Computer Science, page 94-103. Springer, (2013)Molecular Models to Emulate Confinement Effects on the Internal Dynamics of Organophosphorous Hydrolase., , , , and . BSB, volume 5167 of Lecture Notes in Computer Science, page 68-78. Springer, (2008)