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Currently displaying 381 - 400 of 30626 publications

Comparison of protein-glycosaminoglycan interactions in ff14sb/GLYCAM06j and CHARMM36m force fields

K Bojarski, P Wesołowski, D Dewan, Ł Dziadek, V Neuman, B Brooks, J Czub, M Zacharias, A Sieradzan, D Wales

(2025)

(doi: 10.26434/chemrxiv-2025-fl9pf)

Data-rich high-throughput mapping of protein phase behaviour in condensate function and dysfunction

CM Fischer

(2025)

(doi: 10.17863/CAM.130505)

Modeling biomolecular condensates across scales: atomistic, coarse-grained, and data-driven approaches

MJ Maristany, A Emelianova, PY Chew, A Aguirre, R Collepardo-Guevara, JA Joseph

Advances in physics: X

(2025)

2592547

(doi: 10.1080/23746149.2025.2592547)

Global properties of the energy landscape: a testing and training arena for machine learned potentials

V Cărare, FL Thiemann, JD Morrow, DJ Wales, EO Pyzer-Knapp, L Dicks

Npj Computational Materials

(2025)

(doi: 10.1038/s41524-025-01878-x)

Optical Ising spin-glass simulator with tunable short-range couplings

L Delloye, G Jacucci, R Pandya, D Pierangeli, C Conti, S Gigan

Physical Review A

(2025)

112

063510

(doi: 10.1103/mwx5-32rj)

High-fidelity human chromosome transfer and elimination

G Petris, S Grazioli, L van Bijsterveldt, P Murat, KC Liu, J Birnbaum, JE Sale, JW Chin

Science (New York, N.Y.)

(2025)

390

1038

(doi: 10.1126/science.adv9797)

Monte Carlo methods, 70 years after "Equation of state calculations by fast computing machines" by Nicholas Metropolis, Arianna Rosenbluth, Marshall Rosenbluth, Augusta Teller, and Edward Teller (1953).

EJ Maginn, JI Siepmann, KA Fichthorn, D Frenkel, Y Okamoto, W Krauth, C Filippi

J Chem Phys

(2025)

163

210402

(doi: 10.1063/5.0309018)

Exposures in indoor air affecting health

M Hartiala, V Elenius, AA Pesquera, S Androulakis, I Annesi-Maesano, A Badyda, S Brandsma, I Chatziprodromidou, G Gajski, J Garcia-Aymerich, C Giorio, T Hugg, JJK Jaakkola, S Koch, PEG Leonards, A Matrali, L Melymuk, N Mueller, A Muszyński, J Opbroek, I Paciência, SN Pandis, S Pozdniakova, AK Rantala, SR Sufuentes, L Schenk, E Sugeng, A Sunyer-Caldú, A Vantarakis, A Zherebker, E Alfaro-Moreno, PB Nizzetto, JF Dominguez, S Karatzas, F Mureddu, H Salonen, N Papadopoulos, T Jartti, IDEAL Consortium

Allergy European Journal of Allergy and Clinical Immunology

(2025)

700

(doi: 10.1111/all.70179)

Multiscale structure of chromatin condensates explains phase separation and material properties.

H Zhou, J Huertas, MJ Maristany, K Russell, JH Hwang, R-W Yao, N Samanta, J Hutchings, R Billur, M Shiozaki, X Zhao, LK Doolittle, BA Gibson, A Soranno, M Riggi, JR Espinosa, Z Yu, E Villa, R Collepardo-Guevara, MK Rosen

Science

(2025)

390

eadv6588

(doi: 10.1126/science.adv6588)

MMP-cleavable linker platform for tumour-responsive homo- and heterobivalent antibody-drug conjugates.

AJ Counsell, SJ Walsh, N Ashman, M Park, FM Dannheim, TA King, T Wharton, JS Carroll, DR Spring

Chemical science

(2025)

2722

(doi: 10.1039/d5sc06664f)

Observation of unique stable nano-assemblies of a lipidated glucagon-like peptide 1 analogue.

E Prada Brichtova, AL Gomes Dos Santos, SE Jackson

Soft matter

(2025)

9152

(doi: 10.1039/d5sm00801h)

Protein-protein interactions drive differences in the spatiotemporal dynamics of transcription factors NANOG and SOX2 in naïve pluripotent cells

GG Agsu, Y Cao, D Jain, SE Strawbridge, S Daly, Z Zhang, A Wurmser, K Bowers, IO De Almeida, G Nikolenyi, S Berger, M Jonaitis, K Guma’a, T Pauzaite, S Maretvadakethope, L Bates, JA Nathan, BD Hendrich, R Perez-Carrasco, KJ Chalut, D Klenerman, TE Boroviak, SF Lee, D Holcman, S Basu

(2025)

(doi: 10.64898/2025.12.03.691924)