دنبال کردن
Matteo Salvalaglio
Matteo Salvalaglio
University College London, Department of Chemical Engineering
ایمیل تأیید شده در ucl.ac.uk - صفحهٔ اصلی
عنوان
نقل شده توسط
نقل شده توسط
سال
Promoting transparency and reproducibility in enhanced molecular simulations‏
Nature methods 16 (8), 670-673, 2019‏
7722019
Kinetics of protein–ligand unbinding: Predicting pathways, rates, and rate-limiting steps‏
P Tiwary, V Limongelli, M Salvalaglio, M Parrinello‏
Proceedings of the National Academy of Sciences 112 (5), E386-E391, 2015‏
3852015
Assessing the reliability of the dynamics reconstructed from metadynamics‏
M Salvalaglio, P Tiwary, M Parrinello‏
Journal of chemical theory and computation 10 (4), 1420-1425, 2014‏
2182014
Uncovering molecular details of urea crystal growth in the presence of additives‏
M Salvalaglio, T Vetter, F Giberti, M Mazzotti, M Parrinello‏
Journal of the American Chemical Society 134 (41), 17221-17233, 2012‏
2122012
Molecular-dynamics simulations of urea nucleation from aqueous solution‏
M Salvalaglio, C Perego, F Giberti, M Mazzotti, M Parrinello‏
Proceedings of the National Academy of Sciences 112 (1), E6-E14, 2015‏
1842015
Into the dynamics of a supramolecular polymer at submolecular resolution‏
D Bochicchio, M Salvalaglio, GM Pavan‏
Nature Communications 8 (1), 147, 2017‏
1332017
Determination of energies and sites of binding of PFOA and PFOS to human serum albumin‏
M Salvalaglio, I Muscionico, C Cavallotti‏
The journal of physical chemistry B 114 (46), 14860-14874, 2010‏
1242010
Diffusion and aggregation of sodium fluorescein in aqueous solutions‏
T Casalini, M Salvalaglio, G Perale, M Masi, C Cavallotti‏
The Journal of Physical Chemistry B 115 (44), 12896-12904, 2011‏
1202011
Controlling and predicting crystal shapes: The case of urea‏
M Salvalaglio, T Vetter, M Mazzotti, M Parrinello‏
Angewandte Chemie 125 (50), 13611-13614, 2013‏
1172013
Metadynamics studies of crystal nucleation‏
F Giberti, M Salvalaglio, M Parrinello‏
IUCrJ 2 (2), 256-266, 2015‏
1102015
Analyzing and driving cluster formation in atomistic simulations‏
GA Tribello, F Giberti, GC Sosso, M Salvalaglio, M Parrinello‏
Journal of chemical theory and computation 13 (3), 1317-1327, 2017‏
972017
Insight into the nucleation of urea crystals from the melt‏
F Giberti, M Salvalaglio, M Mazzotti, M Parrinello‏
Chemical Engineering Science 121, 51-59, 2014‏
892014
Molecular dynamics simulations of solutions at constant chemical potential‏
C Perego, M Salvalaglio, M Parrinello‏
The Journal of chemical physics 142 (14), 2015‏
852015
Synthetic design of growth factor sequestering extracellular matrix mimetic hydrogel for promoting in vivo bone formation‏
HJ Yan, T Casalini, G Hulsart-Billström, S Wang, OP Oommen, ...‏
Biomaterials 161, 190-202, 2018‏
842018
Concentration gradient driven molecular dynamics: a new method for simulations of membrane permeation and separation‏
A Ozcan, C Perego, M Salvalaglio, M Parrinello, O Yazaydin‏
Chemical science 8 (5), 3858-3865, 2017‏
832017
Urea homogeneous nucleation mechanism is solvent dependent‏
M Salvalaglio, M Mazzotti, M Parrinello‏
Faraday discussions 179, 291-307, 2015‏
752015
Molecular modeling of Protein A affinity chromatography‏
M Salvalaglio, L Zamolo, V Busini, D Moscatelli, C Cavallotti‏
Journal of Chromatography A 1216 (50), 8678-8686, 2009‏
662009
Structural characterization of a Protein A mimetic peptide dendrimer bound to human IgG‏
D Moiani, M Salvalaglio, C Cavallotti, A Bujacz, I Redzynia, G Bujacz, ...‏
The Journal of Physical Chemistry B 113 (50), 16268-16275, 2009‏
602009
Overcoming time scale and finite size limitations to compute nucleation rates from small scale well tempered metadynamics simulations‏
M Salvalaglio, P Tiwary, GM Maggioni, M Mazzotti, M Parrinello‏
The Journal of chemical physics 145 (21), 2016‏
532016
DeepIce: A deep neural network approach to identify ice and water molecules‏
M Fulford, M Salvalaglio, C Molteni‏
Journal of Chemical Information and Modeling 59 (5), 2141-2149, 2019‏
442019
سیستم در حال حاضر قادر به انجام عملکرد نیست. بعداً دوباره امتحان کنید.
مقاله‌ها 1–20