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A novel method for in silico assessment of Methionine oxidation risk in monoclonal antibodies: Improvement over the 2-shell model

PloS one, 2022-12, Vol.17 (12), p.e0279689-e0279689

2022

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Immunodominance in T cell responses elicited against different domains of detoxified pneumolysin PlyD1

PloS one, 2018-03, Vol.13 (3), p.e0193650-e0193650

2018

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Conformational Transitions Induced by the Binding of MgATP to the Vitamin B12 ATP-binding Cassette (ABC) Transporter BtuCD

The Journal of biological chemistry, 2004-10, Vol.279 (43), p.45013-45019

2004

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The Dynamics of the MgATP-driven Closure of MalK, the Energy-transducing Subunit of the Maltose ABC Transporter

The Journal of biological chemistry, 2006-09, Vol.281 (38), p.28397-28407

2006

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Accurate Prediction of Protein Thermodynamic Stability Changes upon Residue Mutation using Free Energy Perturbation

Journal of molecular biology, 2022-01, Vol.434 (2), p.167375-167375, Article 167375

2022

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Computer simulations of membrane proteins

Biochimica et biophysica acta, 2004-11, Vol.1666 (1), p.158-189

2004

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Correlations between Cytotoxicity and Topography of Some 2-Arylidenebenzocycloalkanones Determined by X-ray Crystallography

Journal of medicinal chemistry, 2002-07, Vol.45 (14), p.3103-3111

2002

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Structure-guided Antigen Engineering Yields Pneumolysin Mutants Suitable for Vaccination against Pneumococcal Disease

The Journal of biological chemistry, 2011-04, Vol.286 (14), p.12133-12140

2011

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A Conformational and Structure−Activity Relationship Study of Cytotoxic 3,5-Bis(arylidene)-4-piperidones and Related N-Acryloyl Analogues

Journal of medicinal chemistry, 2001-02, Vol.44 (4), p.586-593

2001

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Computer simulations of ABC transporter components

Biochemistry and cell biology, 2006-12, Vol.84 (6), p.900

2006

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Cytotoxic N-[4-(3-aryl-3-oxo-1-propenyl)phenylcarbonyl]-3,5-bis(phenylmethylene)-4-piperidones and related compounds

European journal of medicinal chemistry, 2002-12, Vol.37 (12), p.961-972

2002

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Cytotoxic 2,6-bis(arylidene)cyclohexanones and related compounds

European journal of medicinal chemistry, 2000-11, Vol.35 (11), p.967-977

2000

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Computer simulations of ABC transporter componentsThis paper is one of a selection of papers published in this Special Issue, entitled CSBMCB — Membrane Proteins in Health and Disease

Biochemistry and cell biology, 2006-12, Vol.84 (6), p.900-911

2006

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Cytotoxic 1,3-diarylidene-2-tetralones and related compounds

European journal of medicinal chemistry, 2002-10, Vol.37 (10), p.813-824

2002

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A novel method for in silico assessment of Methionine oxidation risk in monoclonal antibodies: Improvement over the 2-shell model

PloS one, 2022-01, Vol.17 (12)

2022

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Cytotoxic 1,4-bis(2-oxo-1-cycloalkylmethylene)benzenes and related compounds

European journal of medicinal chemistry, 2002, Vol.37 (1), p.35-44

2002

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Conformational Transitions Induced by the Binding of MgATP to the Vitamin B sub(12) ATP-binding Cassette (ABC) Transporter BtuCD

The Journal of biological chemistry, 2004-10, Vol.279 (43), p.45013-45019

2004

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cis -3-Phenyl-3,3a,4,5-tetrahydrobenzo[ g ]indazole-2-carboxamide

Acta crystallographica. Section E, Structure reports online, 2004-04, Vol.60 (4), p.o610-o612

2004

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Cytotoxic N-[4-(3-aryl-3-oxo-1-propenyl)phenylcarbonyl]-3,5-bis(phenylmethylene)-4-piperid ones and related compounds

European journal of medicinal chemistry, 2002, Vol.37 (12), p.961-972

2002

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(E)‐1‐(4‐Carboxyphenylmethylene)‐2‐tetralone

Acta crystallographica. Section E, Structure reports online, 2002-06, Vol.58 (6), p.o687-o688

2002

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2‐(2,4‐Dichlorophenylhydroxymethyl)‐1‐tetralone

Acta crystallographica. Section E, Structure reports online, 2002-05, Vol.58 (5), p.o582-o583

2002

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1-(4-Carboethoxyphenylmethyl)-2-ethoxynaphthalene

Acta crystallographica. Section E, Structure reports online, 2002-06, Vol.58 (6), p.o689-o690

2002

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Domain coupling in the ABC transporter system BtuCD/BtuF: molecular dynamics simulation, normal mode analysis and protein-protein docking

21st International Symposium on High Performance Computing Systems and Applications (HPCS'07), 2007, p.17-17

2007

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cis‐3‐Phenyl‐3,3a,4,5‐tetrahydrobenzo[g]indazole‐2‐carboxamide

Acta crystallographica. Section E, Structure reports online, 2004-04, Vol.60 (4), p.o610-o612

2004

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1‐(4‐Carboethoxyphenylmethyl)‐2‐ethoxynaphthalene

Acta crystallographica. Section E, Structure reports online, 2002-06, Vol.58 (6), p.o689-o690

2002

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A novel method for in silico assessment of Methionine oxidation risk in monoclonal antibodies: Improvement over the 2-shell model

Immunodominance in T cell responses elicited against different domains of detoxified pneumolysin PlyD1

Conformational Transitions Induced by the Binding of MgATP to the Vitamin B12 ATP-binding Cassette (ABC) Transporter BtuCD

The Dynamics of the MgATP-driven Closure of MalK, the Energy-transducing Subunit of the Maltose ABC Transporter

Accurate Prediction of Protein Thermodynamic Stability Changes upon Residue Mutation using Free Energy Perturbation

Computer simulations of membrane proteins

Correlations between Cytotoxicity and Topography of Some 2-Arylidenebenzocycloalkanones Determined by X-ray Crystallography

Structure-guided Antigen Engineering Yields Pneumolysin Mutants Suitable for Vaccination against Pneumococcal Disease

A Conformational and Structure−Activity Relationship Study of Cytotoxic 3,5-Bis(arylidene)-4-piperidones and Related N-Acryloyl Analogues

Computer simulations of ABC transporter components

Cytotoxic N-[4-(3-aryl-3-oxo-1-propenyl)phenylcarbonyl]-3,5-bis(phenylmethylene)-4-piperidones and related compounds

Cytotoxic 2,6-bis(arylidene)cyclohexanones and related compounds

Computer simulations of ABC transporter componentsThis paper is one of a selection of papers published in this Special Issue, entitled CSBMCB — Membrane Proteins in Health and Disease

Cytotoxic 1,3-diarylidene-2-tetralones and related compounds

A novel method for in silico assessment of Methionine oxidation risk in monoclonal antibodies: Improvement over the 2-shell model

Cytotoxic 1,4-bis(2-oxo-1-cycloalkylmethylene)benzenes and related compounds

Conformational Transitions Induced by the Binding of MgATP to the Vitamin B sub(12) ATP-binding Cassette (ABC) Transporter BtuCD

cis -3-Phenyl-3,3a,4,5-tetrahydrobenzo[ g ]indazole-2-carboxamide

Cytotoxic N-[4-(3-aryl-3-oxo-1-propenyl)phenylcarbonyl]-3,5-bis(phenylmethylene)-4-piperid ones and related compounds

(E)‐1‐(4‐Carboxyphenylmethylene)‐2‐tetralone

2‐(2,4‐Dichlorophenylhydroxymethyl)‐1‐tetralone

1-(4-Carboethoxyphenylmethyl)-2-ethoxynaphthalene

Domain coupling in the ABC transporter system BtuCD/BtuF: molecular dynamics simulation, normal mode analysis and protein-protein docking

cis‐3‐Phenyl‐3,3a,4,5‐tetrahydrobenzo[g]indazole‐2‐carboxamide

1‐(4‐Carboethoxyphenylmethyl)‐2‐ethoxynaphthalene

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