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Radiation and Environmental Biophysics|January 1, 1989
Inactivation of lactate dehydrogenase by UV radiation in the 300 nm wavelength regionE P Chen, P G Söderberg, A D MacKerell, et al.Biochemistry|August 13, 2010
Targeting of an interrupted polypurine:polypyrimidine sequence in mammalian cells by a triplex-forming oligonucleotide containing a novel base analogueA Semenyuk, E Darian, J Liu, et al.Nucleosides, Nucleotides & Nucleic Acids|September 21, 2001
Inhibition of (cytosine C5)-methyltransferase by oligonucleotides containing flexible (cyclopentane) and conformationally constrained (bicyclo[3.1.0]hexane) abasic sitesV E Marquez, P Wang, M C Nicklaus, et al.Bioorganic & Medicinal Chemistry|November 1, 2000
Identification of HIV-1 integrase inhibitors via three-dimensional database searching using ASV and HIV-1 integrases as targetsI J Chen, N Neamati, M C Nicklaus, et al.Journal of Computational Chemistry|July 4, 2009
CHARMM general force field: A force field for drug-like molecules compatible with the CHARMM all-atom additive biological force fieldsK Vanommeslaeghe, E Hatcher, C Acharya, et al.Cancer Research|January 15, 1997
Comparative molecular field analysis-based predictive model of structure-function relationships of polyamine transport inhibitors in L1210 cellsY Li, A D MacKerell, M J Egorin, et al.The Journal of Physical Chemistry. B|June 4, 2014
All-atom empirical potential for molecular modeling and dynamics studies of proteinsA D MacKerell, D Bashford, M Bellott, et al.Journal of Computational Chemistry|May 16, 2009
CHARMM: the biomolecular simulation programB R Brooks, C L Brooks, A D Mackerell, et al.Pageof 4