Romain Berraud‐Pache

Centre National de la Recherche Scientifique — France

Biochemistry, Genetics and Molecular Biology · Life Sciences

13h-index977citations55works3.52yr avg
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Research Topics

bioluminescence and chemiluminescence research(28), Photoreceptor and optogenetics research(15), Nicotinic Acetylcholine Receptors Study(6), Crystallization and Solubility Studies(5), X-ray Diffraction in Crystallography(5)

Publications55 total

When light betrays colour: the photodegradation of alizarin, a historical dye, in basic media
Dyes and Pigments·2025· 2 cited
In-silico color prediction process for natural dyes in Madder
Dyes and Pigments·2025· 2 citedOpen Access
Progress in modeling complex dye mixtures: a case study for cultural heritage
New Journal of Chemistry·2025Open Access
Reversible Control of Native GluN2B-Containing NMDA Receptors with Visible Light
ACS Chemical Neuroscience·2024· 5 citedOpen Access
Rapid and complete prediction of alizarin in solution by combining experimental data with computational methods
Dyes and Pigments·2024· 11 citedOpen Access
Rapid and complete prediction of Madder natural dyes’ color and properties through computational method
2024· 1 citedOpen Access
Using computational chemistry to explore the dyeing process and decipher the secrets of Madder molecules
SPIRE - Sciences Po Institutional REpository·2023
Oily bioorganoclays in drilling fluids: Micro and macroscopic properties
Applied Clay Science·2023· 8 citedOpen Access
Reversible inhibition of GluN2B-containing NMDA receptors with an <i>in situ</i> red-shifted, photoswitchable antagonist
2023· 2 citedOpen Access
Intercalation of lecithin into bentonite: pH dependence and intercalation mechanism
Applied Clay Science·2023· 8 citedOpen Access
Alizarin
ioChem-BD Computational Chemistry Datasets·2023Open Access
Biocomposites based on bentonite and lecithin: An experimental approach supported by molecular dynamics
Applied Clay Science·2022· 7 citedOpen Access
Modelling absorption and emission spectra for bioluminescence
SPIRE - Sciences Po Institutional REpository·2022
Modélisation des spectres d’absorption et d’émission du système bioluminescent de la luciole par des approches QM/MM
SPIRE - Sciences Po Institutional REpository·2022
Light emitted by bioluminescence: A theoretical investigation
SPIRE - Sciences Po Institutional REpository·2021
52.3: <i>Invited Paper:</i> Prediction of Excited State Lifetimes and Properties for OLED Materials Using Quantum Theory: The ORCA Software.
SID Symposium Digest of Technical Papers·2021
Modelling absorption and emission spectra taking into account the dynamic environment: example of firefly bioluminescent systems
SPIRE - Sciences Po Institutional REpository·2021
25‐2: <i>Invited Paper:</i> Predicting Excited State Lifetimes from Scratch Using Quantum Theory: Results from the ORCA Software
SID Symposium Digest of Technical Papers·2021
Redesigning donor–acceptor Stenhouse adduct photoswitches through a joint experimental and computational study
Chemical Science·2021· 32 citedOpen Access
Accurate Computation of the Absorption Spectrum of Chlorophyll <i>a</i> with Pair Natural Orbital Coupled Cluster Methods
The Journal of Physical Chemistry B·2020· 97 citedOpen Access
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Frequent Co-authors

Isabelle Navizet(28), Cristina García‐Iriepa(14), Madjid Zemmouche(10), Maguy Jaber(8), Stefan Schramm(6), Pancě Naumov(6), Róbert Izsák(5), Frank Neese(4), Naba K. Nath(4), Pascal Oesau(4), Dieter G. Weiss(4), Rainer Beckert(4), Giovanni Bistoni(3), Fabrice Pointillart(3), Julie Jung(3), Boris Le Guennic(3), Vincent Dorcet(3), Stéphane Golhen(3), Olivier Cador(3), Olivier Maury(3)