A new model for the binding of flexible ligands to proteins

Computer-aided discrimination between active and inactive mutants of the N-terminal domain of the bacteriophage lambda repressor.

Journal of molecular biology·1996

Effects on protein structure and function of replacing tryptophan with 5-hydroxytryptophan: single-tryptophan mutants of the N-terminal domain of the bacteriophage lambda repressor.

Journal of protein chemistry·1996

The energy of formation of internal loops in triple-helical collagen polypeptides.

Biopolymers·1995

Structure of the type I collagen molecule based on conformational energy computations: the triple-stranded helix and the N-terminal telopeptide.

Journal of molecular biology·1995

The effect of the l-azetidine-2-carboxylic acid residue on protein conformation. IV. Local substitutions in the collagen triple helix.

Biopolymers·1994

Stabilization of the triple-helical structure of natural collagen by side-chain interactions.

Biochemistry·1993

Factors Influencing the Selection of α-Amino Acids over β-Amino Acids in Nature: Studies Involving Protein-l-isoaspartyl Methyltransferase Substrates and Related Peptides.

Biochemistry·2026

Spontaneous Refolding of Escherichia coli Methionine Adenosyltransferase (MetK) Is Extremely Slow, Indicative of Chaperone Dependence.

Biochemistry·2026

Mena EVH1 Interacts with PTP1B Via a Distributed Interface Without Regulating Enzymatic Activity.

Biochemistry·2026

Development of a FRET-Based Assay for Human Neutral Sphingomyelinase 2.

Biochemistry·2026

Suppression of Thermal Protein Aggregation by Acetylation of Lysine Side Chains.

Biochemistry·2026

A Pair of FAD-Dependent Carbohydrate Oxidases from the Corn Smut Pathogen Ustilago maydis Oxidize Chitosan Oligomers.

Biochemistry·2026

Iron(II) and Copper(II) Ions Modulating Binding Interaction of Sugar-Based Silatrane With DNA: Analytical and Theoretical Validation.

Chemistry & biodiversity·2026

Modular assembly and property profiling of an expansive, shape-defined library of pentacyclic saturated N-heterocycles.

Chemical science·2026

A Rationally Designed Split Lettuce Aptamer Based on Large-Scale Mutational Analysis.

ACS sensors·2026

A curated benchmark for cofolding models on kinase conformational states.

npj drug discovery·2026

Multi-objective optimization in the context of generative chemistry.

Nature communications·2026

Preclinical pharmacokinetics and biodistribution of the dual adenosine A2A/A2B inhibitor muvadenant (M1069) in rats.

Xenobiotica; the fate of foreign compounds in biological systems·2026

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A new model for the binding of flexible ligands to proteins

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Computer-aided discrimination between active and inactive mutants of the N-terminal domain of the bacteriophage lambda repressor.

Effects on protein structure and function of replacing tryptophan with 5-hydroxytryptophan: single-tryptophan mutants of the N-terminal domain of the bacteriophage lambda repressor.

The energy of formation of internal loops in triple-helical collagen polypeptides.

Structure of the type I collagen molecule based on conformational energy computations: the triple-stranded helix and the N-terminal telopeptide.

The effect of the l-azetidine-2-carboxylic acid residue on protein conformation. IV. Local substitutions in the collagen triple helix.

Stabilization of the triple-helical structure of natural collagen by side-chain interactions.

Factors Influencing the Selection of α-Amino Acids over β-Amino Acids in Nature: Studies Involving Protein-l-isoaspartyl Methyltransferase Substrates and Related Peptides.

Spontaneous Refolding of Escherichia coli Methionine Adenosyltransferase (MetK) Is Extremely Slow, Indicative of Chaperone Dependence.

Mena EVH1 Interacts with PTP1B Via a Distributed Interface Without Regulating Enzymatic Activity.

Development of a FRET-Based Assay for Human Neutral Sphingomyelinase 2.

Suppression of Thermal Protein Aggregation by Acetylation of Lysine Side Chains.

A Pair of FAD-Dependent Carbohydrate Oxidases from the Corn Smut Pathogen Ustilago maydis Oxidize Chitosan Oligomers.

Iron(II) and Copper(II) Ions Modulating Binding Interaction of Sugar-Based Silatrane With DNA: Analytical and Theoretical Validation.

Modular assembly and property profiling of an expansive, shape-defined library of pentacyclic saturated N-heterocycles.

A Rationally Designed Split Lettuce Aptamer Based on Large-Scale Mutational Analysis.

A curated benchmark for cofolding models on kinase conformational states.

Multi-objective optimization in the context of generative chemistry.

Preclinical pharmacokinetics and biodistribution of the dual adenosine A2A/A2B inhibitor muvadenant (M1069) in rats.

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A new model for the binding of flexible ligands to proteins

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