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- Currently displaying 13261 - 13280 of 29458 publications
Quasi-Continuous Interpolation Scheme for Pathways between Distant Configurations.
– Journal of chemical theory and computation
(2012)
8,
5020
(doi: 10.1021/ct3004832)
UHPLC-DAD method for the determination of neonicotinoid insecticides in single bees and its relevance in honeybee colony loss investigations
– Anal Bioanal Chem
(2012)
405,
1007
(doi: 10.1007/s00216-012-6338-3)
Release of High-Energy Water as an Essential Driving Force for the High-Affinity Binding of Cucurbit[n]urils
– J Am Chem Soc
(2012)
134,
15318
(doi: 10.1021/ja303309e)
Application of fragment screening and merging to the discovery of inhibitors of the mycobacterium tuberculosis cytochrome P450 CYP121.
– Angewandte Chemie (International ed. in English)
(2012)
51,
9311
(doi: 10.1002/anie.201202544)
Synthesis and antibacterial and antifungal evaluation of some chalcone based sulfones and bisulfones
– European journal of medicinal chemistry
(2012)
59,
23
(doi: 10.1016/j.ejmech.2012.09.004)
Pointillist structural color in Pollia fruit
– Proc Natl Acad Sci U S A
(2012)
109,
15712
(doi: 10.1073/pnas.1210105109)
Alternative splicing of a protein domain indispensable for function of transient receptor potential melastatin 3 (TRPM3) ion channels
– The Journal of biological chemistry
(2012)
287,
36663
(doi: 10.1074/jbc.M112.396663)
Mean-field theory of the phase diagram of ultrasoft, oppositely charged polyions in solution
– The Journal of Chemical Physics
(2012)
137,
094905
(doi: 10.1063/1.4748378)
Probability Based hERG Blocker Classifiers
– Molecular informatics
(2012)
31,
679
(doi: 10.1002/minf.201200011)
Full Configuration Interaction Excitations of Ethene and Butadiene: Resolution of an Ancient Question
– J Chem Theory Comput
(2012)
8,
4441
(doi: 10.1021/ct300486d)
Using ligand-mapping simulations to design a ligand selectively targeting a cryptic surface pocket of polo-like kinase 1
– Angew Chem Int Ed Engl
(2012)
51,
10078
(doi: 10.1002/anie.201205676)
A general theory of DNA-mediated and other valence-limited colloidal interactions
– Journal of Chemical Physics
(2012)
137,
094108
(doi: 10.1063/1.4748100)
Hsp90: Structure and Function
– Topics in current chemistry
(2012)
328,
155
(doi: 10.1007/128-2012-356)
Examining basilar membrane motion of an auditory model by using tone-burst otoacoustic emissions
– Biomedizinische Technik. Biomedical engineering
(2012)
57 Suppl 1,
285
(doi: 10.1515/bmt-2012-4145)
Development of a phantom to modulate the maternal and fetal pulse curve for pulse oximetry measurements.
– Biomedizinische Technik. Biomedical engineering
(2012)
57 Suppl 1,
/j/bmte.2012.57.issue-s1-O/bmt-2012-4204/bmt-2012-
(doi: 10.1515/bmt-2012-4204)
Inclusion of Many-Body Effects in the Additive CHARMM Protein CMAP Potential Results in Enhanced Cooperativity of α-Helix and β-Hairpin Formation
– Biophysical Journal
(2012)
103,
1045
(doi: 10.1016/j.bpj.2012.07.042)
Efficient long-range stereochemical communication and cooperative effects in self-assembled Fe4L6 cages.
– J Am Chem Soc
(2012)
134,
15528
(doi: 10.1021/ja306615d)
Predicting genes involved in human cancer using network contextual information.
– J Integr Bioinform
(2012)
9,
210
(doi: 10.2390/biecoll-jib-2012-210)
Synthesis of Enantiomerically Enriched 3-Amino-2-oxindoles through a Palladium-Mediated Asymmetric Intramolecular Arylation of α-Ketimino Amides
– Org Lett
(2012)
14,
4810
(doi: 10.1021/ol302119j)
Characterization of Zn‐Containing Metal–Organic Frameworks by Solid‐State 67Zn NMR Spectroscopy and Computational Modeling
– Chemistry – A European Journal
(2012)
18,
12251
(doi: 10.1002/chem.201201563)