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Publications by Ignacio Soteras Gutierrez
Parametrization of Halogen Bonds in the CHARMM General Force Field
Biophysical Journal
Biophysics
Related publications
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
Improved Modeling of Halogenated Ligand-Protein Interactions Using the Drude Polarizable Force Field and Additive CHARMM36/CHARMM General Force Field (CGenFF)
Biophysical Journal
Biophysics
Systematic Parameterization of Lignin for the Charmm Force Field
Biophysical Journal
Biophysics
Automation of the CHARMM General Force Field (CGenFF) II: Assignment of Bonded Parameters and Partial Atomic Charges
Journal of Chemical Information and Modeling
Computer Science Applications
Chemistry
Chemical Engineering
Library
Information Sciences
Examining the Stability of Β-Sheets Using the Charmm Drude Polarizable Force Field
Biophysical Journal
Biophysics
Parameterization of the Charmm Force Field for Ether Lipids and Model Linear Ethers
Biophysical Journal
Biophysics
Polarizable General Force Field for Drug-Like Molecules: Drude General Force Field (DGenFF)
Biophysical Journal
Biophysics
Development of the Charmm Drude Polarizable Force Field for the Study of Ion Interactions in Biological Systems
Biophysical Journal
Biophysics
Parametrization and Validation of a Force Field for Liquid-Crystal Forming Molecules
Physical Review E
