Suchergebnisse - "Cavasotto, Claudio"

PubPharm (12)

1

The Impact of Supervised Learning Methods in Ultralarge High-Throughput Docking

enthalten in: Journal of chemical information and modeling | 2023

von Cavasotto, C. | Di Filippo, J.

2

Machine Learning Toxicity Prediction : Latest Advances by Toxicity End Point

enthalten in: ACS omega | 2022

von Cavasotto, C. | Scardino, V.

3

Guided structure-based ligand identification and design via artificial intelligence modeling

enthalten in: Expert opinion on drug discovery | 2022

von Di Filippo, J. | Cavasotto, C.

4

Artificial intelligence in the early stages of drug discovery

enthalten in: Archives of biochemistry and biophysics | 2021

von Cavasotto, C. | Di Filippo, J.

5

Binding Free Energy Calculation Using Quantum Mechanics Aimed for Drug Lead Optimization

enthalten in: Methods in molecular biology (Clifton, N.J.) | 2020

von Cavasotto, C.

6

Molecular Docking Using Quantum Mechanical-Based Methods

enthalten in: Methods in molecular biology (Clifton, N.J.) | 2020

von Aucar, M. | Cavasotto, C.

7

Quantum Chemical Approaches in Structure-Based Virtual Screening and Lead Optimization

enthalten in: Frontiers in chemistry | 2018

von Cavasotto, C. | Adler, N. | Aucar, M.

8

Open challenges in structure-based virtual screening : Receptor modeling, target flexibility consideration and active site water molecules description

enthalten in: Archives of biochemistry and biophysics | 2015

von Spyrakis, F. | Cavasotto, C.

9

Homology models in docking and high-throughput docking

enthalten in: Current topics in medicinal chemistry | 2011

von Cavasotto, C.

10

Homology modeling in drug discovery : current trends and applications

enthalten in: Drug discovery today | 2009

von Cavasotto, C. | Phatak, S.