Protein‐based virtual screening of chemical databases. II. Are homology models of g‐protein coupled receptors suitable targets?

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1994 • 63,397 citations

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1995 • 12,826 citations

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1990 • 2,969 citations

A Fast Flexible Docking Method using an Incremental Construction Algorithm

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1997 • 1,617 citations

Requirement of Rigid-Body Motion of Transmembrane Helices for Light Activation of Rhodopsin

1996 • 1,159 citations

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1994 • 1,070 citations

A General and Fast Scoring Function for Protein−Ligand Interactions: A Simplified Potential Approach

1999 • 978 citations

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1998 • 937 citations

Projection structure of rhodopsin

1993 • 758 citations

Protein-Based Virtual Screening of Chemical Databases. 1. Evaluation of Different Docking/Scoring Combinations

2000 • 722 citations

Consensus Scoring: A Method for Obtaining Improved Hit Rates from Docking Databases of Three-Dimensional Structures into Proteins

1999 • 681 citations

An alpha-carbon template for the transmembrane helices in the rhodopsin family of G-protein-coupled receptors 1 1Edited by R. Huber

1997 • 639 citations

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New 4-Point Pharmacophore Method for Molecular Similarity and Diversity Applications: Overview of the Method and Applications, Including a Novel Approach to the Design of Combinatorial Libraries Containing Privileged Substructures

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Virtual screening and fast automated docking methods

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1991 • 330 citations

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The Binding Site of Neuropeptide Vasopressin V1a Receptor

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1996 • 190 citations

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1992 • 165 citations

Predicting Binding Affinities of Protein Ligands from Three-Dimensional Models: Application to Peptide Binding to Class I Major Histocompatibility Proteins

1999 • 161 citations

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1996 • 154 citations

Agonist-induced Conformational Changes at the Cytoplasmic Side of Transmembrane Segment 6 in the β2 Adrenergic Receptor Mapped by Site-selective Fluorescent Labeling

2001 • 140 citations

Novel GPCRs and their endogenous ligands: expanding the boundaries of physiology and pharmacology

1999 • 134 citations

ConsDock: A new program for the consensus analysis of protein–ligand interactions

2002 • 115 citations

New Diarylmethylpiperazines as Potent and Selective Nonpeptidic δ Opioid Receptor Agonists with Increased In Vitro Metabolic Stability

2000 • 114 citations

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1996 • 100 citations

Evaluation of the CASP2 docking section

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Homology Modeling Using Multiple Molecular Dynamics Simulations and Docking Studies of the Human Androgen Receptor Ligand Binding Domain Bound to Testosterone and Nonsteroidal Ligands

2001 • 91 citations

Docking ligands onto binding site representations derived from proteins built by homology modelling

2001 • 90 citations

Hydrophobic Residues of the D₂ Dopamine Receptor Are Important for Binding and Signal Transduction

1995 • 82 citations

De Novo Design, Synthesis, and Biological Activities of High-Affinity and Selective Non-Peptide Agonists of the δ-Opioid Receptor

1998 • 67 citations

Conserved aromatic residues in the transmembrane region VI of the V_1a vasopressin receptor differentiate agonist vs. antagonist ligand binding

2000 • 61 citations

Novel “Restoration of Function” Mutagenesis Strategy to Identify Amino Acids of the δ-Opioid Receptor Involved in Ligand Binding

1997 • 54 citations

The conformational switch in 7-transmembrane receptors: the muscarinic receptor paradigm

1999 • 50 citations

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1998 • 49 citations

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1999 • 36 citations

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1997 • 25 citations

Beyond uHTS: ridiculously HTS?

2000 • 22 citations

Identification of Transmembrane Regions Critical for Ligand Binding to the Human D₃Dopamine Receptor Using Various D₃/D₁Transmembrane Chimeras

1998 • 20 citations