Gerald Monard

According to our database, Gerald Monard authored at least 8 papers between 2005 and 2023.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2023

Quantum Mechanical Prediction of Dissociation Constants for Thiazol-2-imine Derivatives.

Evrim Arslan, Zeynep Pinar Haslak, Gerald Monard, Ilknur Dogan, Viktorya Aviyente

J. Chem. Inf. Model., May, 2023

2022

Impact of Deamidation on the Structure and Function of Antiapoptotic Bcl-xL.

Gamze Tanriver, Gerald Monard, Saron Catak

J. Chem. Inf. Model., 2022

2021

Using Atomic Charges to Describe the pKa of Carboxylic Acids.

Zeynep Pinar Haslak, Sabrina Zareb, Ilknur Dogan, Viktorya Aviyente, Gerald Monard

J. Chem. Inf. Model., 2021

2019

Semi-Empirical Born-Oppenheimer Molecular Dynamics (SEBOMD) within the Amber Biomolecular Package.

Antoine Marion, Hatice Gokcan, Gerald Monard

J. Chem. Inf. Model., 2019

2017

Digitizing Poly-l-lysine Dendrigrafts: From Experimental Data to Molecular Dynamics Simulations.

Jean-Patrick Francoia, Jean-Christophe Rossi, Gerald Monard, Laurent Vial

J. Chem. Inf. Model., September, 2017

Assessing protein-ligand binding modes with computational tools: the case of PDE4B.

Gülsah Çifci, Viktorya Aviyente, E. Demet Akten, Gerald Monard

J. Comput. Aided Mol. Des., 2017

2014

Rationalization of the p<i>K</i>_a Values of Alcohols and Thiols Using Atomic Charge Descriptors and Its Application to the Prediction of Amino Acid p<i>K</i>_a's.

Ilke Ugur, Antoine Marion, Stéphane Parant, Jan H. Jensen, Gerald Monard

J. Chem. Inf. Model., 2014

2005

Computing Molecular Potential Energy Surface with DIET.

Emmanuel Jeannot, Gerald Monard

Proceedings of the International Symposium on Information Technology: Coding and Computing (ITCC 2005), 2005