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Recent advances in the development of catalytic inhibitors of human DNA topoisomerase IIα as novel anticancer agents

Current medicinal chemistry, 2013-02, Vol.20 (5), p.694-709

2013

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Electrostatic effects in proteins: comparison of dielectric and charge models

Protein engineering, 1991-12, Vol.4 (8), p.903-910

1991

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Enzyme Binding Selectivity Prediction: α-Thrombin vs Trypsin Inhibition

Journal of Chemical Information and Computer Sciences, 2004-09, Vol.44 (5), p.1872-1882

2004

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Prediction of binding affinities of thrombin and trypsin inhibitors by chemometric modeling

Journal of chemometrics, 2007-07, Vol.21 (7‐9), p.346-356

2007

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Characterization of quercetin binding site on DNA gyrase

Biochemical and biophysical research communications, 2003-06, Vol.306 (2), p.530-536

2003

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Kinetic Study of Two Novel Enantiomeric Tricyclic β-Lactams Which Efficiently Inactivate Class C β-Lactamases

Antimicrobial Agents and Chemotherapy, 2001-08, Vol.45 (8), p.2215-2223

2001

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Distinct labelling of fusion events in rat lactotrophs by FM 1-43 and FM 4-64 is associated with conformational differences

Acta Physiologica, 2007-09, Vol.191 (1), p.35-42

2007

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Structural and Functional Characterization of Enantiomeric Glutamic Acid Derivatives as Potential Transition State Analogue Inhibitors of MurD Ligase

Journal of molecular biology, 2007-06, Vol.370 (1), p.107-115

2007

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Conformational analysis of 7-oxoacyl- l-alanyl- d-isoglutamines

International journal of pharmaceutics, 2000-04, Vol.199 (1), p.59-64

2000

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Prediction of Enzyme Binding: Human Thrombin Inhibition Study by Quantum Chemical and Artificial Intelligence Methods Based on X-ray Structures

Journal of Chemical Information and Computer Sciences, 2001-09, Vol.41 (5), p.1286-1294

2001

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In silico fragment-based discovery of indolin-2-one analogues as potent DNA gyrase inhibitors

Bioorganic & medicinal chemistry letters, 2005-12, Vol.15 (23), p.5207-5210

2005

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Electrostatic screening in molecular dynamics simulations

Protein engineering, 1991-12, Vol.4 (8), p.911-917

1991

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Design, synthesis and molecular modelling of 1-amidinopiperidine thrombin inhibitors

Pharmazie, 2007-04, Vol.62 (4), p.243-254

2007

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Modeling solvent effects in molecular dynamics simulations of proteins

International journal of quantum chemistry, 1992-09, Vol.44 (2), p.291-299

1992

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Quantitative Structure−Activity Relationship of Flavonoid Analogues. 3. Inhibition of p56lck Protein Tyrosine Kinase

Journal of Chemical Information and Computer Sciences, 2000-07, Vol.40 (4), p.994-1001

2000

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Computational approach towards the three-dimensional structure of E. coli tyrosine aminotransferase

FEBS letters, 1992-07, Vol.306 (2), p.234-238

1992

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Biophysical characterization of an indolinone inhibitor in the ATP-binding site of DNA gyrase

Biochemical and biophysical research communications, 2006-11, Vol.349 (4), p.1206-1213

2006

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Design and structure–activity relationship of thrombin inhibitors with an azaphenylalanine scaffold: potency and selectivity enhancements via P2 optimization

Bioorganic & medicinal chemistry, 2001-10, Vol.9 (10), p.2745-2756

2001

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Quantitative Structure−Activity Relationship of Flavonoid p56lck Protein Tyrosine Kinase Inhibitors. A Neural Network Approach

Journal of Chemical Information and Computer Sciences, 1997-11, Vol.37 (6), p.990-998

1997

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Thrombin inhibitors built on an azaphenylalanine scaffold

Bioorganic & medicinal chemistry letters, 2004-03, Vol.14 (6), p.1563-1567

2004

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Design of a novel thymopoietin analogue based on conformational analyses

Drug design and delivery, 1990-09, Vol.6 (3), p.213

Solmajer, T

1990

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Use of distance geometry approach for the in vitro antiviral activity evaluation of N-bridgehead C-nucleosides

European journal of medicinal chemistry, 1992, Vol.27 (3), p.259-266

1992

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Conformational Study of Catecholamines in Solution

Zeitschrift für Naturforschung C. A journal of biosciences, 1983-10, Vol.38 (9), p.758-762

1983

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Structural Investigation of 5-Hydrazono-5,6,7,8-tetrahydro-2H-1-benzopyran-2-ones and 5,6,7,8-Tetrahydroquinoline-2,5(1H)-diones

Journal of Chemical Information and Computer Sciences, 1997-05, Vol.37 (3), p.489-494

1997

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Thermolysis of 2,4,6-trichlorophenol chemisorbed on aluminium oxides as example of fly ash mediated surface catalysis reaction in PCDD/PCDF formation

Chemosphere (Oxford), 2002-03, Vol.46 (9), p.1279-1286

2002

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Recent advances in the development of catalytic inhibitors of human DNA topoisomerase IIα as novel anticancer agents

Electrostatic effects in proteins: comparison of dielectric and charge models

Enzyme Binding Selectivity Prediction: α-Thrombin vs Trypsin Inhibition

Prediction of binding affinities of thrombin and trypsin inhibitors by chemometric modeling

Characterization of quercetin binding site on DNA gyrase

Kinetic Study of Two Novel Enantiomeric Tricyclic β-Lactams Which Efficiently Inactivate Class C β-Lactamases

Distinct labelling of fusion events in rat lactotrophs by FM 1-43 and FM 4-64 is associated with conformational differences

Structural and Functional Characterization of Enantiomeric Glutamic Acid Derivatives as Potential Transition State Analogue Inhibitors of MurD Ligase

Conformational analysis of 7-oxoacyl- l-alanyl- d-isoglutamines

Prediction of Enzyme Binding: Human Thrombin Inhibition Study by Quantum Chemical and Artificial Intelligence Methods Based on X-ray Structures

In silico fragment-based discovery of indolin-2-one analogues as potent DNA gyrase inhibitors

Electrostatic screening in molecular dynamics simulations

Design, synthesis and molecular modelling of 1-amidinopiperidine thrombin inhibitors

Modeling solvent effects in molecular dynamics simulations of proteins

Quantitative Structure−Activity Relationship of Flavonoid Analogues. 3. Inhibition of p56lck Protein Tyrosine Kinase

Computational approach towards the three-dimensional structure of E. coli tyrosine aminotransferase

Biophysical characterization of an indolinone inhibitor in the ATP-binding site of DNA gyrase

Design and structure–activity relationship of thrombin inhibitors with an azaphenylalanine scaffold: potency and selectivity enhancements via P2 optimization

Quantitative Structure−Activity Relationship of Flavonoid p56lck Protein Tyrosine Kinase Inhibitors. A Neural Network Approach

Thrombin inhibitors built on an azaphenylalanine scaffold

Design of a novel thymopoietin analogue based on conformational analyses

Use of distance geometry approach for the in vitro antiviral activity evaluation of N-bridgehead C-nucleosides

Conformational Study of Catecholamines in Solution

Structural Investigation of 5-Hydrazono-5,6,7,8-tetrahydro-2H-1-benzopyran-2-ones and 5,6,7,8-Tetrahydroquinoline-2,5(1H)-diones

Thermolysis of 2,4,6-trichlorophenol chemisorbed on aluminium oxides as example of fly ash mediated surface catalysis reaction in PCDD/PCDF formation

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