Baptiste Demoulin

Marseille, 13397, France

Last Updated: 09/26/2026

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Found 17 publications

The Newton-X platform for mixed quantum-classical dynamics.

The Newton-X platform for mixed quantum-classical dynamics.

Journal: Physical chemistry chemical physics : PCCP

Published: June 16, 2026

Assessing Nonadiabatic Dynamics Methods in Long Timescales.

Assessing Nonadiabatic Dynamics Methods in Long Timescales.

Journal: Journal of chemical theory and computation

Published: December 16, 2024

Newton-X Platform: New Software Developments for Surface Hopping and Nuclear Ensembles.

Newton-X Platform: New Software Developments for Surface Hopping and Nuclear Ensembles.

Journal: Journal of chemical theory and computation

Published: October 04, 2022

Trajectory Surface Hopping for a Polarizable Embedding QM/MM Formulation.

Trajectory Surface Hopping for a Polarizable Embedding QM/MM Formulation.

Journal: The journal of physical chemistry. A

Published: September 15, 2022

Simulations of molecular photodynamics in long timescales.

Simulations of molecular photodynamics in long timescales.

Journal: Philosophical transactions. Series A, Mathematical, physical, and engineering sciences

Published: March 28, 2022

A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled Cluster Type Methods.

A New Benchmark Set for Excitation Energy of Charge Transfer States: Systematic Investigation of Coupled Cluster Type Methods.

Journal: Journal of chemical theory and computation

Published: June 06, 2020

A domain-based local pair natural orbital implementation of the equation of motion coupled cluster method for electron attached states.

A domain-based local pair natural orbital implementation of the equation of motion coupled cluster method for electron attached states.

Journal: The Journal of chemical physics

Published: May 03, 2019

Multilayer Approach to the IP-EOM-DLPNO-CCSD Method: Theory, Implementation, and Application.

Multilayer Approach to the IP-EOM-DLPNO-CCSD Method: Theory, Implementation, and Application.

Journal: Journal of chemical theory and computation

Published: March 13, 2019

Assessement of Awareness of, Concerns and Attitudes Towards HIV-Related Court-Case Sentences in France in a Representative Sample of People Living with HIV (ANRS VESPA2 Survey).

Assessement of Awareness of, Concerns and Attitudes Towards HIV-Related Court-Case Sentences in France in a Representative Sample of People Living with HIV (ANRS VESPA2 Survey).

Journal: AIDS and behavior

Published: March 08, 2018

Self-Reported Bothersome Symptoms Across Different Socioepidemiological Groups of People Living With HIV Attending French Hospitals: Results From the ANRS-VESPA2 Survey.

Self-Reported Bothersome Symptoms Across Different Socioepidemiological Groups of People Living With HIV Attending French Hospitals: Results From the ANRS-VESPA2 Survey.

Journal: Journal of pain and symptom management

Published: December 06, 2016

Sexual Behavior with Serodiscordant Partners Among HIV-Positive Men Who Have Sex with Men Followed Up in Hospitals Between 2003 and 2011 in France: Results from a Repeated National Representative Survey (ANRS VESPA and VESPA2).

Sexual Behavior with Serodiscordant Partners Among HIV-Positive Men Who Have Sex with Men Followed Up in Hospitals Between 2003 and 2011 in France: Results from a Repeated National Representative Survey (ANRS VESPA and VESPA2).

Journal: AIDS patient care and STDs

Published: May 10, 2016

Uptake of PrEP and condom and sexual risk behavior among MSM during the ANRS IPERGAY trial.

Uptake of PrEP and condom and sexual risk behavior among MSM during the ANRS IPERGAY trial.

Journal: AIDS care

Published: February 18, 2016

Showing 1-12 of 17

Last Updated: 09/26/2026