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SuperTarget goes quantitative: update on drug-target interactions

Nucleic acids research, 2012-01, Vol.40 (D1), p.D1113-D1117

2012

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Mental health care needs and preferences for mothers of children with a disability

Child : care, health & development, 2018-05, Vol.44 (3), p.384-391

2018

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BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities

Nucleic acids research, 2007-01, Vol.35 (Database issue), p.D198-D201

2007

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Identification of quantitative trait loci affecting reproduction in pigs

Journal of animal science, 2001-03, Vol.79 (3), p.623

2001

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Experimental characterization of the association of β-cyclodextrin and eight novel cyclodextrin derivatives with two guest compounds

Journal of computer-aided molecular design, 2021-01, Vol.35 (1), p.95-104

2021

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BindingDB: a web-accessible molecular recognition database

Combinatorial chemistry & high throughput screening, 2001-12, Vol.4 (8), p.719-725

2001

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Prediction of Ph-dependent Properties of Proteins

Journal of molecular biology, 1994-05, Vol.238 (3), p.415-436

1994

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Toward Expanded Diversity of Host–Guest Interactions via Synthesis and Characterization of Cyclodextrin Derivatives

Journal of solution chemistry, 2018-11, Vol.47 (10), p.1597-1608

2018

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Bio-inspired CO2 reduction by a rhenium tricarbonyl bipyridine-based catalyst appended to amino acids and peptidic platforms: incorporating proton relays and hydrogen-bonding functional groups

Faraday discussions, 2017-06, Vol.198, p.279-300

2017

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Open "Back Door" in a Molecular Dynamics Simulation of Acetylcholinesterase

Science (American Association for the Advancement of Science), 1994-03, Vol.263 (5151), p.1276-1278

1994

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Calculation of the total electrostatic energy of a macromolecular system: Solvation energies, binding energies, and conformational analysis

Proteins, structure, function, and bioinformatics, 1988, Vol.4 (1), p.7-18

1988

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The statistical-thermodynamic basis for computation of binding affinities: a critical review

Biophysical journal, 1997-03, Vol.72 (3), p.1047-1069

1997

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Ligand-receptor docking with the Mining Minima optimizer

Journal of computer-aided molecular design, 2001-02, Vol.15 (2), p.157-171

2001

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Bio-inspired CO 2 reduction by a rhenium tricarbonyl bipyridine-based catalyst appended to amino acids and peptidic platforms: incorporating proton relays and hydrogen-bonding functional groups

Faraday discussions, 2017-06, Vol.198, p.279-300

2017

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Multiple-site titration and molecular modeling: Two rapid methods for computing energies and forces for ionizable groups in proteins

Proteins, structure, function, and bioinformatics, 1993-03, Vol.15 (3), p.266-282

Gilson, Michael K.

1993

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Calculation of electrostatic potentials in an enzyme active site

Nature (London), 1987-11, Vol.330 (6143), p.84-86

1987

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Thermodynamic linkage between the binding of protons and inhibitors to HIV-1 protease

Protein science, 1999-01, Vol.8 (1), p.180-195

1999

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Optically trapped aqueous droplets for single molecule studies

Applied physics letters, 2006-07, Vol.89 (1), p.013904-013904-3

2006

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Energetics of charge-charge interactions in proteins

Proteins, structure, function, and bioinformatics, 1988, Vol.3 (1), p.32-52

1988

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ConCept: de Novo Design of Synthetic Receptors for Targeted Ligands [J. Chem. Inf. Model. 47, 425−434 (2007)]

Journal of chemical information and modeling, 2007-09, Vol.47 (5), p.1998-1998

2007

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Proflavine Acts as a Rev Inhibitor by Targeting the High-Affinity Rev Binding Site of the Rev Responsive Element of HIV-1

Biochemistry (Easton), 2003-07, Vol.42 (26), p.8035-8046

2003

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The Physical Basis of Nucleic Acid Base Stacking in Water

Biophysical journal, 2001, Vol.80 (1), p.140-148

2001

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Destabilization of an α -helix-bundle Protein by Helix Dipoles

Proceedings of the National Academy of Sciences - PNAS, 1989-03, Vol.86 (5), p.1524-1528

1989

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The dielectric constant of a folded protein

Biopolymers, 1986-11, Vol.25 (11), p.2097-2119

1986

Volltextzugriff (PDF)

Theory of electrostatic interactions in macromolecules

Current opinion in structural biology, 1995-04, Vol.5 (2), p.216-223

Gilson, Michael K

1995

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SuperTarget goes quantitative: update on drug-target interactions

Mental health care needs and preferences for mothers of children with a disability

BindingDB: a web-accessible database of experimentally determined protein-ligand binding affinities

Identification of quantitative trait loci affecting reproduction in pigs

Experimental characterization of the association of β-cyclodextrin and eight novel cyclodextrin derivatives with two guest compounds

BindingDB: a web-accessible molecular recognition database

Prediction of Ph-dependent Properties of Proteins

Toward Expanded Diversity of Host–Guest Interactions via Synthesis and Characterization of Cyclodextrin Derivatives

Bio-inspired CO2 reduction by a rhenium tricarbonyl bipyridine-based catalyst appended to amino acids and peptidic platforms: incorporating proton relays and hydrogen-bonding functional groups

Open "Back Door" in a Molecular Dynamics Simulation of Acetylcholinesterase

Calculation of the total electrostatic energy of a macromolecular system: Solvation energies, binding energies, and conformational analysis

The statistical-thermodynamic basis for computation of binding affinities: a critical review

Ligand-receptor docking with the Mining Minima optimizer

Bio-inspired CO 2 reduction by a rhenium tricarbonyl bipyridine-based catalyst appended to amino acids and peptidic platforms: incorporating proton relays and hydrogen-bonding functional groups

Multiple-site titration and molecular modeling: Two rapid methods for computing energies and forces for ionizable groups in proteins

Calculation of electrostatic potentials in an enzyme active site

Thermodynamic linkage between the binding of protons and inhibitors to HIV-1 protease

Optically trapped aqueous droplets for single molecule studies

Energetics of charge-charge interactions in proteins

ConCept: de Novo Design of Synthetic Receptors for Targeted Ligands [J. Chem. Inf. Model. 47, 425−434 (2007)]

Proflavine Acts as a Rev Inhibitor by Targeting the High-Affinity Rev Binding Site of the Rev Responsive Element of HIV-1

The Physical Basis of Nucleic Acid Base Stacking in Water

Destabilization of an α -helix-bundle Protein by Helix Dipoles

The dielectric constant of a folded protein

Theory of electrostatic interactions in macromolecules

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