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Molecular structure

Modelling aptamers with nucleic acid mimics (NAM): From sequence to three-dimensional docking

Ricardo Oliveira, Eva Pinho, [ ... ], Carina Almeida

Critical pore size for micropore filling in coal samples with different rank coals

Lin Hong, Wenjing Wang, Dameng Gao, Wentong Liu

Higher-order structure of DNA determines its positioning in cell-size droplets under crowded conditions

Takashi Nishio, Yuko Yoshikawa, Kenichi Yoshikawa

Interaction between β-lactoglobulin and EGCG under high-pressure by molecular dynamics simulation

Yechuan Huang, Xicai Zhang, Huayi Suo

Impact of nanodisc lipid composition on cell-free expression of proton-coupled folate transporter

Hoa Quynh Do, Carla M. Bassil, Elizabeth I. Andersen, Michaela Jansen

Mining the Protein Data Bank to improve prediction of changes in protein-protein binding

Samuel Coulbourn Flores, Athanasios Alexiou, Anastasios Glaros

Tau fibril with membrane lipids: Insight from computational modeling and simulations

Prechiel A. Barredo, Marvin Jose F. Fernandez, Christopher E. Ambe, Mannix P. Balanay

Fused ring effect on optical nonlinearity and structure property relationship of anthracenyl chalcone based push-pull chromophores

Dian Alwani Zainuri, Mundzir Abdullah, [ ... ], Ibrahim Abdul Razak

The influences of electric field intensity and driving force on the slip behaviour of water flow in a nanochannel

Qiwei Liu, Dezheng Wang, [ ... ], Xiaopeng Yu

Dabrafenib, idelalisib and nintedanib act as significant allosteric modulator for dengue NS3 protease

R. V. Sriram Uday, Rajdip Misra, [ ... ], Nakul C. Maiti

A community-powered search of machine learning strategy space to find NMR property prediction models

Lars A. Bratholm, Will Gerrard, [ ... ], David R. Glowacki

Anchoring the T6SS to the cell wall: Crystal structure of the peptidoglycan binding domain of the TagL accessory protein

Van Son Nguyen, Silvia Spinelli, [ ... ], Philippe Leone

Chiral deaza-coelenterazine analogs for probing a substrate-binding site in the Ca²⁺-binding photoprotein aequorin

Satoshi Inouye, Yuto Sumida, [ ... ], Takamitsu Hosoya

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