(Q36827832)

16 August 2017

Towards the automatic design of synthetically accessible protein ligands: peptides, amides and peptidomimetics (English)

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16 August 2017

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Böhm HJ

1

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PubMed ID

8877698

16 August 2017

language of work or name

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1 August 1996

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Journal of Computer - Aided Molecular Design

16 August 2017

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16 August 2017

10

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16 August 2017

265-272

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16 August 2017

4

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https://scigraph.springernature.com/pub.10.1007/bf00124496

16 August 2017

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A fast and efficient method to generate biologically relevant conformations

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12 December 2020

PRO_LIGAND: an approach to de novo molecular design. 4. Application to the design of peptides

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12 December 2020

Computer design of bioactive molecules: a method for receptor-based de novo ligand design

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12 December 2020

The development of a simple empirical scoring function to estimate the binding constant for a protein-ligand complex of known three-dimensional structure

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12 December 2020

Nonpeptidic inhibitors of human leukocyte elastase. 5. Design, synthesis, and X-ray crystallography of a series of orally active 5-aminopyrimidin-6-one-containing trifluoromethyl ketones

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12 December 2020

The computer program LUDI: a new method for the de novo design of enzyme inhibitors

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12 December 2020

The crystal structures of recombinant glycosylated human renin alone and in complex with a transition state analog inhibitor

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12 December 2020

Pepstatin analogues as novel renin inhibitors

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12 December 2020

Design of orally active, non-peptidic inhibitors of human leukocyte elastase

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12 December 2020

On the use of LUDI to search the Fine Chemicals Directory for ligands of proteins of known three-dimensional structure

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12 December 2020

Evaluation of intrinsic binding energy from a hydrogen bonding group in an enzyme inhibitor

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12 December 2020

The Protein Data Bank: a computer-based archival file for macromolecular structures

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12 December 2020

Structure of human neutrophil elastase in complex with a peptide chloromethyl ketone inhibitor at 1.84-A resolution

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12 December 2020

Measuring diversity: experimental design of combinatorial libraries for drug discovery

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12 December 2020

LUDI: rule-based automatic design of new substituents for enzyme inhibitor leads

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12 December 2020

Restrictions on the binding of proline-containing peptides to elastase

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12 December 2020

SIRIUS. An automated method for the analysis of the preferred packing arrangements between protein groups.

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12 December 2020

Identifiers

DOI

10.1007/BF00124496

1 reference

16 August 2017

journals/jcamd/Bohm96

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DBLP Dataset 2021-01-02

28 January 2021

1 reference

PubMed ID

8877698