Marc C. Nicklaus - Citegraph

Author Info

Name	Affiliation	Papers
MARC C. NICKLAUS	NCI,DIV CANC TREATMENT,MED CHEM LAB,BETHESDA,MD 20892	30
Collaborators	Citations	PageRank
59	186	30.38
Referers	Referees	References
614	290	131

Search Limit

100614

Publications (30 rows)

Collaborators (59 rows)

Referers (100 rows)

Referees (100 rows)

Title	Citations	PageRank	Year
Tautomer Database: A Comprehensive Resource for Tautomerism Analyses.	0	0.34	2020
Computational Approaches To Identify A Hidden Pharmacological Potential In Large Chemical Libraries.	0	0.34	2020
Toward a Comprehensive Treatment of Tautomerism in Chemoinformatics Including in InChI V2.	1	0.36	2020
AntiHIV-Pred: Web-resource for in silico prediction of anti-HIV/AIDS activity.	0	0.34	2020
Adapting CHMTRN (CHeMistry TRaNslator) for a New Use.	0	0.34	2020
DATA MINING APPROACH FOR EXTRACTION OF USEFUL INFORMATION ABOUT BIOLOGICALLY ACTIVE COMPOUNDS FROM PUBLICATIONS.	1	0.35	2019
Experimental and Chemoinformatics Study of Tautomerism in a Database of Commercially Available Screening Samples.	1	0.36	2016
QSAR Modeling Using Large-Scale Databases: Case Study for HIV-1 Reverse Transcriptase Inhibitors.	1	0.42	2015
QSAR Modeling of Imbalanced High-Throughput Screening Data in PubChem.	2	0.37	2014
Enumeration of Ring-Chain Tautomers Based on SMIRKS Rules.	1	0.35	2014
A New Approach to Radial Basis Function Approximation and Its Application to QSAR.	3	0.44	2014
PDB Ligand Conformational Energies Calculated Quantum-Mechanically.	5	0.57	2012
Optical Structure Recognition Application Entry to CLEF-IP 2012.	0	0.34	2012
Optical Structure Recognition Application Entry in Image2Structure Task.	1	0.48	2011
Tautomerism in large databases.	14	0.71	2010
Combining docking with pharmacophore filtering for improved virtual screening.	7	0.62	2009
Optical Structure Recognition Software To Recover Chemical Information: OSRA, An Open Source Solution.	37	2.59	2009
Comparison of Nine Programs Predicting p Values of Pharmaceutical Substances.	0	0.34	2009
Model of full-length HIV-1 integrase complexed with viral DNA as template for anti-HIV drug design.	1	0.41	2004
PROSIT: Pseudo-Rotational Online Service and Interactive Tool, Applied to a Conformational Survey of Nucleosides and Nucleotides.	0	0.34	2004
PASS biological activity spectrum predictions in the enhanced open NCI database browser.	6	0.70	2003
Enhanced CACTVS browser of the Open NCI Database.	22	4.84	2002
Comparison of the NCI Open Database with Seven Large Chemical Structural Databases.	41	4.78	2001
Computational Chemistry on Commodity-Type Computers.	3	0.62	1998
Conformational energies calculated by the molecular mechanics program CHARMm.	0	0.34	1997
Molecular Modeling In The Discovery Of Drug Leads	1	0.65	1996
National-Cancer-Institute Drug Information-System 3d Database	25	3.28	1994
CONCORD and CAMBRIDGE: comparison of computer generated chemical structures with x-ray crystallographic data	5	2.01	1993
Chem-X and CAMBRIDGE. Comparison of computer generated chemical structures with x-ray crystallographic data.	2	0.65	1993
QSAR of conformationally flexible molecules: Comparative molecular field analysis of protein-tyrosine kinase inhibitors	6	2.11	1992