Detalhe da pesquisa
1.
Free-energy landscape and spinodals for the liquid-liquid transition of the TIP4P/2005 and TIP4P/Ice models of water.
J Chem Phys
; 160(10)2024 Mar 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-38456528
2.
Local number fluctuations in ordered and disordered phases of water across temperatures: Higher-order moments and degrees of tetrahedrality.
J Chem Phys
; 160(20)2024 May 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-38775744
3.
How negative mood hinders belief updating in depression: results from two experimental studies.
Psychol Med
; 53(4): 1288-1301, 2023 03.
Artigo
em Inglês
| MEDLINE | ID: mdl-34247664
4.
Comparison of Bayesian Networks, G-estimation and linear models to estimate causal treatment effects in aggregated N-of-1 trials with carry-over effects.
BMC Med Res Methodol
; 23(1): 191, 2023 08 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-37605171
5.
Melting curves of ice polymorphs in the vicinity of the liquid-liquid critical point.
J Chem Phys
; 159(5)2023 Aug 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-37531247
6.
Signatures of a liquid-liquid transition in an ab initio deep neural network model for water.
Proc Natl Acad Sci U S A
; 117(42): 26040-26046, 2020 10 20.
Artigo
em Inglês
| MEDLINE | ID: mdl-33008883
7.
Liquid-Liquid Transition in Water from First Principles.
Phys Rev Lett
; 129(25): 255702, 2022 Dec 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-36608224
8.
Kernel Methods for Predicting Yields of Chemical Reactions.
J Chem Inf Model
; 62(9): 2077-2092, 2022 05 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-34699222
9.
Vapor-liquid equilibrium of water with the MB-pol many-body potential.
J Chem Phys
; 154(21): 211103, 2021 Jun 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-34240989
10.
Predictors of outcome during inpatient psychotherapy for posttraumatic stress disorder: a single-treatment, multi-site, practice-based study.
Psychother Res
; 31(4): 468-482, 2021 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-32762508
11.
Why dysfunctional expectations in depression persist - Results from two experimental studies investigating cognitive immunization.
Psychol Med
; 49(9): 1532-1544, 2019 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-30131084
12.
Linking amorphous ice and supercooled liquid water.
Proc Natl Acad Sci U S A
; 118(34)2021 08 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-34404724
13.
Macromolecular 'size' and 'hardness' drives structure in solvent-swollen blends of linear, cyclic, and star polymers.
Soft Matter
; 14(3): 411-423, 2018 Jan 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-29251311
14.
Introducing the 'active search' method for iterative virtual screening.
J Comput Aided Mol Des
; 29(4): 305-14, 2015 Apr.
Artigo
em Inglês
| MEDLINE | ID: mdl-25636815
15.
Krein support vector machine classification of antimicrobial peptides.
Digit Discov
; 2(2): 502-511, 2023 Apr 11.
Artigo
em Inglês
| MEDLINE | ID: mdl-37065679
16.
Depressive symptoms and weight change in inpatients with anorexia nervosa: A cross-lagged panel model.
J Psychosom Res
; 172: 111391, 2023 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-37285655
17.
Anomalies and Local Structure of Liquid Water from Boiling to the Supercooled Regime as Predicted by the Many-Body MB-pol Model.
J Phys Chem Lett
; 13(16): 3652-3658, 2022 Apr 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-35436129
18.
Pirfenidone Has Anti-fibrotic Effects in a Tissue-Engineered Model of Human Cardiac Fibrosis.
Front Cardiovasc Med
; 9: 854314, 2022.
Artigo
em Inglês
| MEDLINE | ID: mdl-35360018
19.
Inpatient psychotherapy for depression in a large routine clinical care sample: A Bayesian approach to examining clinical outcomes and predictors of change.
J Affect Disord
; 305: 133-143, 2022 05 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35219740
20.
Manifestations of metastable criticality in the long-range structure of model water glasses.
Nat Commun
; 12(1): 3398, 2021 Jun 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-34099681