Results 171 to 180 of about 119,597,839 (255)

In silico design and immunoinformatics evaluation of a multi-epitope vaccine targeting SEPT9 for gastrointestinal adenocarcinomas. [PDF]

BMC Immunol
Kashyap H, Rathi B, Singh H, Kaur N, Sharda S, Sharma AK.   +5 more
europepmc   +1 more source

Conformational changes of lipases: a comparative study and experimental implications

, 2012
EBERT, CYNTHIA, FATTOR, DIANA, FOSCATO, MARCO, GARDOSSI, Lucia, FERRARIO, VALERIO, KNAPIC, Lorena   +5 more
core  

Critical Roles of O‐Acetylation Revealed by Synthetic Trisaccharide Antigens for a Broad‐Spectrum Anti‐Salmonella Vaccine

Advanced Science, EarlyView.
A synthetic glycoconjugate vaccine based on a diacetylated Salmonella trisaccharide elicits broadly protective antibodies against four major human pathogenic serovars. Mechanistic studies identify 2,3‐di‐O‐acetylation of rhamnose as a critical determinant of antigen recognition and breadth of protection, establishing a new strategy for broad‐spectrum ...
Xingling Pan, Soham Maity, Herbert Kavunja, Yuvarani Murali, Ting‐An Chen, Chang‐xin Huo, Scott M. Baliban, Xuefei Huang   +7 more
wiley   +1 more source

In silico design and immunoinformatics assessment of a multiepitope vaccine targeting borealpox virus. [PDF]

Sci Rep
Naveed M, Asim M, Aziz T, Athar A, Majeed MN, Tombozara N, Al-Zaban MI, Shami A, Alwethaynani MS, Al-Joufi FA.   +9 more
europepmc   +1 more source

Understanding laccases stability and glycosylation effect by integrating computational and experimental studies

, 2012
EBERT, CYNTHIA, Golovleva, L., FATTOR, DIANA, FOSCATO, MARCO, SINIGOI, LORIS, GARDOSSI, Lucia, FERRARIO, VALERIO, Cherykh, A.   +7 more
core  

Predicting Enzyme Turnover Numbers and Enabling Rational Enzyme Evolution

Advanced Science, EarlyView.
MCKcat, a deep learning framework combining multi‐scale convolution and cross‐attention, accurately predicts enzyme turnover number (kcat) by fusing sequence and reaction representations. It couples with rational design in a two‐step strategy for Bacillus aryabhattai laccase engineering, achieving a 75% positive rate with synergistically enhanced ...
Fengya Ge, Xiangyang Ma, Jiyan Li, Mengxiang Wang, Fuping Lu, Yihan Liu, Lin Wang   +6 more
wiley   +1 more source

In Silico Design and Analysis of Cyanobacterial Pseudo Natural Products. [PDF]

J Nat Prod
Hernández-Mejías ÁD, Jimenez-Nieves GD, Caro-Diaz EJE.   +2 more
europepmc   +1 more source

Automatic evolution of mutants by means of MODEFRONTIER software

, 2012
EBERT, CYNTHIA, FOSCATO, MARCO, GARDOSSI, Lucia, FERRARIO, VALERIO, KNAPIC, Lorena, Stefano, D. Di   +5 more
core  

Palaeoproteomic Deconvolution of Physical and Genetic Collagen Mixtures

Advanced Science, EarlyView.
ClassiCOL_v2 uses a novel “peptide patching” framework that treats any collagen sample as a patchwork of peptide sequences derived from phylogenetically related species. This allows the algorithm to simultaneously resolve two previously intractable problems: multi‐species samples and/or database deficiencies.
Ian Engels, Tristan Dedrie, Synnøve K. Mo, Simon Van de Vyver, Thijs R. A. Vandenbroucke, Kévin Di Modíca, Jan Decher, Alice Toso, Dieter Deforce, Simon Daled, Alexandra Burnett, Grégory Abrams, Maarten Dhaenens   +12 more
wiley   +1 more source

In Silico Design of Pyrimidine Derivatives as Potential α-Glucosidase Inhibitors: QSAR, Molecular Docking, ADMET, and Molecular Dynamics Studies. [PDF]

Int J Mol Sci
Abchir O, Rossafi B, Bouribab A, Es-Sounni B, Touti R, Yamari I, Samadi A, Chtita S.   +7 more
europepmc   +1 more source