Garland R. Marshall

Orcid: 0000-0002-3098-0332

According to our database1, Garland R. Marshall authored at least 27 papers between 1971 and 2016.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of five.

Timeline

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Bibliography

2016
An Automated Strategy for Binding-Pose Selection and Docking Assessment in Structure-Based Drug Design.
J. Chem. Inf. Model., 2016

2013
Limiting assumptions in molecular modeling: electrostatics.
J. Comput. Aided Mol. Des., 2013

2012
Histone Deacetylase Inhibitors: Structure-Based Modeling and Isoform-Selectivity Prediction.
J. Chem. Inf. Model., 2012

Limiting assumptions in structure-based design: binding entropy.
J. Comput. Aided Mol. Des., 2012

Comprehensive model of wild-type and mutant HIV-1 reverse transciptases.
J. Comput. Aided Mol. Des., 2012

2011
PHOENIX: A Scoring Function for Affinity Prediction Derived Using High-Resolution Crystal Structures and Calorimetry Measurements.
J. Chem. Inf. Model., 2011

2010
SKATE: A docking program that decouples systematic sampling from scoring.
J. Comput. Chem., 2010

2009
A virtual library of constrained cyclic tetrapeptides that mimics all four side-chain orientations for over half the reverse turns in the protein data bank.
J. Comput. Aided Mol. Des., 2009

2006
Do benzodiazepines mimic reverse-turn structures?
J. Comput. Aided Mol. Des., 2006

Development of small molecules designed to modulate protein-protein interactions.
J. Comput. Aided Mol. Des., 2006

2005
Validated ligand mapping of ACE active site.
J. Comput. Aided Mol. Des., 2005

2002
Metal complexes of chiral pentaazacrowns as conformational templates for beta-turn recognition.
J. Comput. Aided Mol. Des., 2002

1995
DBMAKER: A set of programs to generate three-dimensional databases based upon user-specified criteria.
J. Comput. Aided Mol. Des., 1995

Sampling conformational hyperspace: Techniques for improving completeness.
J. Comput. Aided Mol. Des., 1995

1994
De novo Design of Ligand.
Proceedings of the 27th Annual Hawaii International Conference on System Sciences (HICSS-27), 1994

Properties of Intraglobular Contacts in Proteins: An Approach to Prediction of Tertiary Structure.
Proceedings of the 27th Annual Hawaii International Conference on System Sciences (HICSS-27), 1994

1993
SPLICE: A program to assemble partial query solutions from three-dimensional database searches into novel ligands.
J. Comput. Aided Mol. Des., 1993

FOUNDATION: A program to retrieve all possible structures containing a user-defined minimum number of matching query elements from three-dimensional databases.
J. Comput. Aided Mol. Des., 1993

1990
Cavity search: An algorithm for the isolation and display of cavity-like binding regions.
J. Comput. Aided Mol. Des., 1990

1989
Impediments to the scientific method.
J. Comput. Aided Mol. Des., 1989

Constrained search of conformational hyperspace.
J. Comput. Aided Mol. Des., 1989

1988
The veil of commercialism.
J. Comput. Aided Mol. Des., 1988

1987
Computer-aided molecular modeling of a D<sub>2</sub>-agonist dopamine pharmacophore.
J. Comput. Aided Mol. Des., 1987

A unique geometry of the active site of angiotensin-converting enzyme consistent with structure-activity studies.
J. Comput. Aided Mol. Des., 1987

The tower of babel.
J. Comput. Aided Mol. Des., 1987

1975
A macromodular graphics system for protein structure research.
Comput. Graph., 1975

1971
CHEMAST: A Computer Program for Modelling Molecular Structures.
Proceedings of the Information Processing, Proceedings of IFIP Congress 1971, Volume 2, 1971


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