Andrew Dalke - Concepedia

Concepedia

Author

Andrew Dalke

University of Illinois Urbana-Champaign ORCID

Also Known As

A Dalke, A. Dalke, Andrew Dalke, Dalke, Andrew

39

Publications

71.5K

Citations

12

H-Index

49

Concepts

All Affiliations

University of Illinois Urbana-Champaign Roche (Switzerland)Urbana University Thermo Fisher Scientific (Sweden)

AD

About

Andrew Dalke is an author at University of Illinois Urbana-Champaign specializing in computational biology, molecular biology, and engineering.

Top Concepts

#	Concept	H-Index	Publications	Citations
1	Engineering	8	8	65.1K
2	Medicine	4	4	208
3	Natural Sciences	3	3	346
4	Biochemistry	2	2	138
5	Biomolecular Engineering	2	2	583

Andrew Dalke

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13

Publications

71.5K

Citations

12

H-Index

	Year	Citations
VMD: Visual molecular dynamics William Humphrey, Andrew Dalke, Klaus Schulten Journal of Molecular Graphics EngineeringVisual Molecular DynamicsMolecular BiologyComputational ChemistryMolecular Dynamics	1996	64.1K
Biopython: freely available Python tools for computational molecular biology and bioinformatics Peter Cock, Tiago Antão, Jeffrey T. Chang, Bioinformatics	2009	6.2K
NAMD: a Parallel, Object-Oriented Molecular Dynamics Program Mark T. Nelson, William Humphrey, Attila Gürsoy, The International Journal of Supercomputer Applications and High Performance Computing EngineeringMolecular BiologyComputational ChemistryMolecular DynamicsMolecular Design	1996	564
DeepSMILES: An Adaptation of SMILES for Use in Machine-Learning of Chemical Structures Noel M. O’Boyle, Andrew Dalke Structured PredictionEngineeringMachine LearningMolecular BiologyChemistry	2018	208
mmpdb: An Open-Source Matched Molecular Pair Platform for Large Multiproperty Data Sets Andrew Dalke, Jérôme Hert, Christian Krämer Journal of Chemical Information and Modeling Hit IdentificationMolecular BiologyGenomicsChemical BiologyBioinformatics Database	2018	119
DeepSMILES: An Adaptation of SMILES for Use in Machine-Learning of Chemical Structures Noel M. O’Boyle, Andrew Dalke Artificial IntelligenceGenerative SystemDeep Neural NetworksChemical StructuresMachine Learning	2018	113
The chemfp project Andrew Dalke Journal of Cheminformatics	2019	53
FMCS: a novel algorithm for the multiple MCS problem Andrew Dalke, Janna Hastings Journal of Cheminformatics Mathematical ProgrammingEngineeringStructural Pattern RecognitionHit IdentificationChemistry	2013	51
MDScope — a visual computing environment for structural biology Mark T. Nelson, William Humphrey, Richard Kufrin, Computer Physics Communications EngineeringScientific VisualizationComputational BiologyData VisualizationMolecular Biology	1995	50
A visual computing environment for very large scale biomolecular modeling Matthias Zeller, J. C. Phillips, Andrew Dalke, EngineeringMolecular BiologyBiological ComputingMolecular GraphicMolecular Computing	2002	19

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