M C Nicklaus
Overview
Explore the profile of M C Nicklaus including associated specialties, affiliations and a list of published articles.
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Articles
27
Citations
317
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0
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Recent Articles
1.
Pogodin P, Lagunin A, Filimonov D, Nicklaus M, Poroikov V
SAR QSAR Environ Res
. 2019 Sep;
30(10):759-773.
PMID: 31547686
Existing data on structures and biological activities are limited and distributed unevenly across distinct molecular targets and chemical compounds. The question arises if these data represent an unbiased sample of...
2.
Savosina P, Stolbov L, Druzhilovskiy D, Filimonov D, Nicklaus M, Poroikov V
Biomed Khim
. 2019 Apr;
65(2):73-79.
PMID: 30950810
Despite significant advances in the application of highly active antiretroviral therapy, the development of new drugs for the treatment of HIV infection remains an important task because the existing drugs...
3.
Veselovsky A, Zharkova M, Poroikov V, Nicklaus M
SAR QSAR Environ Res
. 2014 Apr;
25(6):457-71.
PMID: 24716798
Protein-protein interactions (PPI) are involved in most of the essential processes that occur in organisms. In recent years, PPI have become the object of increasing attention in drug discovery, particularly...
4.
Sitzmann M, Filippov I, Nicklaus M
SAR QSAR Environ Res
. 2008 Mar;
19(1-2):1-9.
PMID: 18311630
()New data, tools and services recently made available on the web server (http://cactus.nci.nih.gov) of the Computer-Aided Drug Design (CADD) Group, NCI, NIH, developed in the context of chemoinformatics and drug...
5.
Lee J, Han K, Kang J, Pearce L, Lewin N, Yan S, et al.
J Med Chem
. 2001 Dec;
44(25):4309-12.
PMID: 11728178
An approach to reduce the log P in a series of diacylglycerol (DAG)-lactones known for their high binding affinity for protein kinase C (PK-C) is presented. Branched alkyl groups with...
6.
Marquez V, Wang P, Nicklaus M, Maier M, Manoharan M, Christman J, et al.
Nucleosides Nucleotides Nucleic Acids
. 2001 Sep;
20(4-7):451-9.
PMID: 11563060
Pseudorotationally locked sugar analogues based on bicyclo[3.1.0]-hexane templates were placed in DNA duplexes as abasic target sites in the M. HhaI recognition sequence. The binding affinity of the enzyme increases...
7.
Voigt J, Bienfait B, Wang S, Nicklaus M
J Chem Inf Comput Sci
. 2001 Jun;
41(3):702-12.
PMID: 11410049
Eight large chemical databases have been analyzed and compared to each other. Central to this comparison is the open National Cancer Institute (NCI) database, consisting of approximately 250 000 structures....
8.
Nacro K, Sigano D, Yan S, Nicklaus M, Pearce L, Lewin N, et al.
J Med Chem
. 2001 Jun;
44(12):1892-904.
PMID: 11384235
A small, focused combinatorial library encompassing all possible permutations of acyl branched alkyl chains-small and large, saturated and unsaturated-was generated from the active diacylglycerol enantiomer (S-DAG) to help identify the...
9.
Chen I, Neamati N, Nicklaus M, Orr A, Anderson L, Barchi Jr J, et al.
Bioorg Med Chem
. 2000 Nov;
8(10):2385-98.
PMID: 11058033
Integration of viral DNA into the host cell genome is a critical step in the life cycle of HIV. This essential reaction is catalyzed by integrase (IN) through two steps,...
10.
Mu L, Sarafianos S, Nicklaus M, Russ P, Siddiqui M, Ford Jr H, et al.
Biochemistry
. 2000 Sep;
39(37):11205-15.
PMID: 10985766
Molecular dynamics simulations of a ternary complex of HIV-1 reverse transcriptase (RT), double-stranded DNA, and bound dideoxynucleoside-5'-triphosphate (RT-DNA-ddNTP), utilizing the ddNTPs ddATP, betaFddATP, and alphaFddATP, explain the experimentally observed order...