[HTML][HTML] Combined approaches from physics, statistics, and computer science for ab initio protein structure prediction: ex unitate vires (unity is strength)?

M Delarue, P Koehl - F1000Research, 2018 - ncbi.nlm.nih.gov
Connecting the dots among the amino acid sequence of a protein, its structure, and its
function remains a central theme in molecular biology, as it would have many applications in …

Application of molecular simulations toward understanding cellulase mechanisms

M Arora, RM Yennamalli, TZ Sen - BioEnergy Research, 2018 - Springer
Computational approaches have provided new biological insights into the chemical
mechanism of action of cellulases, which are used in the industrial production of bioethanol …

Genetic and structural study of DNA-directed RNA polymerase II of Trypanosoma brucei, towards the designing of novel antiparasitic agents

L Papageorgiou, V Megalooikonomou, D Vlachakis - PeerJ, 2017 - peerj.com
Trypanosoma brucei brucei (TBB) belongs to the unicellular parasitic protozoa organisms,
specifically to the Trypanosoma genus of the Trypanosomatidae class. A variety of different …

Selective preference of parallel DNA triplexes Is due to the disruption of Hoogsteen hydrogen bonds caused by the severe nonisostericity between the G* GC and T …

G Goldsmith, T Rathinavelan, N Yathindra - PLoS One, 2016 - journals.plos.org
Implications of DNA, RNA and RNA. DNA hybrid triplexes in diverse biological functions,
diseases and therapeutic applications call for a thorough understanding of their structure …

Regulation of bottromycin biosynthesis involves an internal transcriptional start site and a cluster-situated modulator

NM Vior, E Cea-Torrescassana, TH Eyles… - Frontiers in …, 2020 - frontiersin.org
Bottromycin is a ribosomally synthesized and post-translationally modified peptide (RiPP)
produced by several streptomycetes, including the plant pathogen Streptomyces scabies …

Metal ion capture mechanism of a copper metallochaperone

DK Chakravorty, P Li, TT Tran, CA Bayse… - Biochemistry, 2016 - ACS Publications
A novel cation− π interaction between the bound Cu+ metal ion and Trp44 in the periplasmic
Cu+/Ag+ metallochaperone Escherichia coli CusF protects Cu+ from the oxidative influence …

[PDF][PDF] Centre de Biophysique Moléculaire: Biophysique théorique et computationnelle

S AUBAILLY - theses.fr
Les protéines sont de grandes macromolécules comprenant des milliers d'atomes et ayant
une taille de 2-5 nm typiquement [12]. Ce sont les molécules les plus représentées dans la …

[PDF][PDF] Combined approaches from physics, statistics, and computer science for protein structure prediction: ab initio ex unitate vires (unity is strength)?[version 1; …

M Delarue, P Koehl - 2018 - pdfs.semanticscholar.org
Connecting the dots among the amino acid sequence of a protein, its structure, and its
function remains a central theme in molecular biology, as it would have many applications in …

From coarse-grained to atomistic molecular modeling: how structure and dynamics shape intra-molecular communication and functional sites in proteins

S Aubailly - 2017 - theses.hal.science
In this thesis we have focused on the elusive relation that exists in proteins between
theircomplex structures and the even more complex and sophisticated functions that they …

[引用][C] D'ORLÉANS ÉCOLE DOCTORALE SCIENCES BIOLOGIQUES ET CHIMIE DU VIVANT

S AUBAILLY