Alexander V. Nemukhin

Часть публикаций из профиля, по году от новых к старым. Это не полный список последних работ автора; работы без года — в конце.

• Сравнение механизмов гидролиза органофосфатов с хорошей и плохой уходящей группой фосфотриэстеразой из Pseudomonas Diminuta2024
• Computer Modeling of the Mechanisms of Enzymatic Reactions: Lessons from 20 Years of Practice2024
• COMPUTER MODELING OF THE MECHANISMS OF ENZYMATIC REACTIONS: LESSONS FROM 20 YEARS OF PRACTICE2024
• Comparison of the Mechanisms of Hydrolysis of Organophosphates with Good and Poor Leaving Group by Phosphotriesterase from Pseudomonas diminuta2024
• Modeling of enzyme-catalyzed P–O bond cleavage in the adenosine triphosphate molecule2024
• Photoinduced Chemistry in Fluorescent Proteins: Curse or Blessing?2016 · аннотациясвернуть

  Photoinduced reactions play an important role in the photocycle of fluorescent proteins from the green fluorescent protein (GFP) family. Among such processes are photoisomerization, photooxidation/photoreduction,…

• Quantum Chemistry Behind Bioimaging: Insights from Ab Initio Studies of Fluorescent Proteins and Their Chromophores2011 · аннотациясвернуть

  The unique properties of green fluorescent protein (GFP) have been harnessed in a variety of bioimaging techniques, revolutionizing many areas of the life sciences. Molecular-level understanding of the underlying…

• Potential Energy Landscape of the Electronic States of the GFP Chromophore in Different Protonation Forms: Electronic Transition Energies and Conical Intersections2010 · аннотациясвернуть

  We present the results of quantum chemical calculations of the transition energies and conical intersection points for the two lowest singlet electronic states of the green fluorescent protein chromophore,…