4.5 Article

Overcoming the Limitations of Fragment Merging: Rescuing a Strained Merged Fragment Series Targeting Mycobacterium tuberculosis CYP121

Related references

Note: Only part of the references are listed.
Article Chemistry, Multidisciplinary

Application of Fragment Screening and Merging to the Discovery of Inhibitors of the Mycobacterium tuberculosis Cytochrome P450 CYP121

Sean A. Hudson et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION (2012)

Article Biochemistry & Molecular Biology

Fragment-Based Approaches in Drug Discovery and Chemical Biology

Duncan E. Scott et al.

BIOCHEMISTRY (2012)

Article Chemistry, Medicinal

Fragment based discovery of a novel and selective PI3 kinase inhibitor

Samantha J. Hughes et al.

BIOORGANIC & MEDICINAL CHEMISTRY LETTERS (2011)

Article Chemistry, Multidisciplinary

Fragment Growing Induces Conformational Changes in Acetylcholine-Binding Protein: A Structural and Thermodynamic Analysis

Ewald Edink et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)

Article Chemistry, Medicinal

Intramolecular Hydrogen Bonding in Medicinal Chemistry

Bernd Kuhn et al.

JOURNAL OF MEDICINAL CHEMISTRY (2010)

Article Chemistry, Multidisciplinary

The Importance of Hydrogen Bonding between the Glutamine Side Chains to the Formation of Amyloid VQIVYK Parallel β-Sheets: An ONIOM DFT/AM1 Study

Joshua A. Plumley et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2010)

Article Biochemistry & Molecular Biology

Hydrogen bonding motifs of protein side chains: Descriptions of binding of arginine and amide groups

Liat Shimoni et al.

PROTEIN SCIENCE (2010)

Review Chemistry, Multidisciplinary

Integrated modeling program, applied chemical theory (IMPACT)

JL Banks et al.

JOURNAL OF COMPUTATIONAL CHEMISTRY (2005)

Review Chemistry, Medicinal

Fragment-based drug discovery

DA Erlanson et al.

JOURNAL OF MEDICINAL CHEMISTRY (2004)

Article Biochemistry & Molecular Biology

Atomic structure of Mycobacterium tuberculosis CYP121 to 1.06 A reveals novel features of cytochrome P450

D Leys et al.

JOURNAL OF BIOLOGICAL CHEMISTRY (2003)

Review Chemistry, Medicinal

Application of NMR screening in drug discovery

J Fejzo et al.

CURRENT TOPICS IN MEDICINAL CHEMISTRY (2003)

Article Chemistry, Medicinal

Design of adenosine kinase inhibitors from the NMR-based screening of fragments

PJ Hajduk et al.

JOURNAL OF MEDICINAL CHEMISTRY (2000)

Article Biotechnology & Applied Microbiology

Discovering novel ligands for macromolecules using X-ray crystallographic screening

VL Nienaber et al.

NATURE BIOTECHNOLOGY (2000)

Article Multidisciplinary Sciences

Site-directed ligand discovery

DA Erlanson et al.

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2000)