Chemical Bonding
Evaluation of mass spectrometry MS/MS spectra for the presence of isopeptide crosslinked peptides
Lawrence M. Schopfer, Seda Onder, Oksana Lockridge, Qi Wu
Article Year: 2021
The iron chelator, PBT434, modulates transcellular iron trafficking in brain microvascular endothelial cells
Danielle K. Bailey, Whitney Clark, Daniel J. Kosman, Kostas Pantopoulos
Article Year: 2021
Probing the role of the residues in the active site of the transaminase from Thermobaculum terrenum
Ekaterina Yu. Bezsudnova, Alena Yu. Nikolaeva, Alina K. Bakunova, Tatiana V. Rakitina, Dmitry A. Suplatov, Vladimir O. Popov, Konstantin M. Boyko, Israel Silman
Article Year: 2021
Prediction of hyaluronic acid target on sucrase-isomaltase (SI) with reverse docking and molecular dynamics simulations for inhibitors binding to SI
Xiao Li, Keqing Qian, Weiwei Han, Dennis Salahub
Article Year: 2021
Prediction of essential binding domains for the endocannabinoid N-arachidonoylethanolamine (AEA) in the brain cannabinoid CB1 receptor
Joong-Youn Shim, Alexandre G. de Brevern
Article Year: 2021
Mosquito metallomics reveal copper and iron as critical factors for Plasmodium infection
Krystal Maya-Maldonado, Victor Cardoso-Jaime, Gabriela González-Olvera, Beatriz Osorio, Benito Recio-Tótoro, Pablo Manrique-Saide, Iram Pablo Rodríguez-Sánchez, Humberto Lanz-Mendoza, Fanis Missirlis, Fidel de la Cruz Hernández-Hernández, Paul O. Mireji
Article Year: 2021
Repeatability of corneal and epithelial thickness measurements with anterior segment optical coherence tomography in keratoconus
Ye Li, Akilesh Gokul, Charles McGhee, Mohammed Ziaei, Ireneusz Grulkowski
Article Year: 2021
Structures of the human cholecystokinin 1 (CCK1) receptor bound to Gs and Gq mimetic proteins provide insight into mechanisms of G protein selectivity
Jesse I. Mobbs, Matthew J. Belousoff, Kaleeckal G. Harikumar, Sarah J. Piper, Xiaomeng Xu, Sebastian G. B. Furness, Hari Venugopal, Arthur Christopoulos, Radostin Danev, Denise Wootten, David M. Thal, Laurence J. Miller, Patrick M. Sexton, Kylie J. Walters
Article Year: 2021
Identification of 3’-UTR single nucleotide variants and prediction of select protein imbalance in mesial temporal lobe epilepsy patients
Tanusree Chaudhuri, Janaki Chintalapati, Madhusoodan Vijayacharya Hosur, Giuseppe Biagini
Article Year: 2021
Can UVA-light-activated riboflavin-induced collagen crosslinking be transferred from ophthalmology to spine surgery? A feasibility study on bovine intervertebral disc
Ioannis Vasilikos, Graciosa Q. Teixeira, Andreas Seitz, Julia Nothelfer, Julian Haas, Hans-Joachim Wilke, Boris Mizaikoff, Jürgen Beck, Ulrich Hubbe, Cornelia Neidlinger-Wilke, Demetrios G. Vavvas
Article Year: 2021
Structure elucidation and docking analysis of 5M mutant of T1 lipase Geobacillus zalihae
Siti Nor Hasmah Ishak, Nor Hafizah Ahmad Kamarudin, Mohd Shukuri Mohamad Ali, Adam Thean Chor Leow, Fairolniza Mohd Shariff, Raja Noor Zaliha Raja Abd Rahman, Muhammad Aamer Mehmood
Article Year: 2021
Repeatability and agreement of biometric measurements using spectral domain anterior segment optical coherence tomography and Scheimpflug tomography in keratoconus
Ye Li, Akilesh Gokul, Charles McGhee, Mohammed Ziaei, Manuel Garza León
Article Year: 2021
Unraveling the unbinding pathways of SARS-CoV-2 Papain-like proteinase known inhibitors by Supervised Molecular Dynamics simulation
Farzin Sohraby, Hassan Aryapour, Emilio Gallicchio
Article Year: 2021
Computational designing of a peptide that potentially blocks the entry of SARS-CoV, SARS-CoV-2 and MERS-CoV
Priya V. K., Satish Prasad Rath, Parvin Abraham, Jean-Christophe Nebel
Article Year: 2021
Natural plant products as potential inhibitors of RNA dependent RNA polymerase of Severe Acute Respiratory Syndrome Coronavirus-2
Shruti Koulgi, Vinod Jani, Mallikarjunachari Uppuladinne V. N., Uddhavesh Sonavane, Rajendra Joshi, Chandrabose Selvaraj
Article Year: 2021
PD-L1 signaling on human memory CD4+ T cells induces a regulatory phenotype
Giorgia Fanelli, Marco Romano, Estefania Nova-Lamperti, Mariana Werner Sunderland, Alessandra Nerviani, Cristiano Scottà, Michele Bombardieri, Sergio A. Quezada, Steven H. Sacks, Randolph J. Noelle, Costantino Pitzalis, Robert I. Lechler, Giovanna Lombardi, Pablo D. Becker, Paula M. Oliver
Article Year: 2021
Supercoiled DNA and non-equilibrium formation of protein complexes: A quantitative model of the nucleoprotein ParBS partition complex
Jean-Charles Walter, Thibaut Lepage, Jérôme Dorignac, Frédéric Geniet, Andrea Parmeggiani, John Palmeri, Jean-Yves Bouet, Ivan Junier, Alexander MacKerell
Article Year: 2021
PharmaNet: Pharmaceutical discovery with deep recurrent neural networks
Paola Ruiz Puentes, Natalia Valderrama, Cristina González, Laura Daza, Carolina Muñoz-Camargo, Juan C. Cruz, Pablo Arbelaez, Alexandre G. de Brevern
Article Year: 2021
Molecular basis of F-actin regulation and sarcomere assembly via myotilin
Julius Kostan, Miha Pavšič, Vid Puž, Thomas C. Schwarz, Friedel Drepper, Sibylle Molt, Melissa Ann Graewert, Claudia Schreiner, Sara Sajko, Peter F. M. van der Ven, Adekunle Onipe, Dmitri I. Svergun, Bettina Warscheid, Robert Konrat, Dieter O. Fürst, Brigita Lenarčič, Kristina Djinović-Carugo, Laura Machesky, Ines Alvarez-Garcia
Article Year: 2021
Effects of poly-γ-glutamic acid and poly-γ-glutamic acid super absorbent polymer on the sandy loam soil hydro-physical properties
Jianzhong Guo, Wenjuan Shi, Jiake Li, Zhongmin Zhai, Du Changwen
Article Year: 2021