LEAD MOLECULAR DESIGN
Lead Molecular Design provides research of algorithms and applications for drug discovery.
LEAD MOLECULAR DESIGN
Social Links:
Industry:
Biotechnology Pharmaceutical Product Search Software
Founded:
2002-01-01
Address:
Sant Cugat Del Vallès, Catalonia, Spain
Country:
Spain
Website Url:
http://www.leadmolecular.com
Total Employee:
1+
Status:
Active
Contact:
349-359-07828
Email Addresses:
[email protected]
Technology used in webpage:
Microsoft Exchange Online Google Maps Microsoft Azure DNS Google Maps API
Official Site Inspections
http://www.leadmolecular.com
- Host name: verdiell.atmosfera.net
- IP address: 79.143.92.80
- Location: Priego de Cordoba Spain
- Latitude: 37.4381
- Longitude: -4.1952
- Timezone: Europe/Madrid
- Postal: 14800
More informations about "Lead Molecular Design"
Lead Molecular Design - Crunchbase Company Profile & Funding
Lead Molecular Design provides research of algorithms and applications for drug discovery.See details»
Lead Molecular Design, S. L. | LinkedIn
Lead Molecular Design, S.L. is a small company dedicated to the research of new algorithms and application in the field of Drug Discovery.See details»
OptADMET: a web-based tool for substructure modifications to …
Jan 23, 2024 · Lead optimization is a crucial step in the drug discovery process, which aims to design potential drug candidates from biologically active hits. During lead optimization, active …See details»
Lead Optimization in Drug Discovery | Danaher Life Sciences
Lead optimization is the final phase of drug discovery that focuses on optimizing different characteristics of lead compounds, such as target selectivity, biological activity, potency, and …See details»
Discovery and optimization of lead molecules in drug designing
Jan 1, 2022 · Computational drug designing plays a pivotal role in the discovery of novel lead molecules with their structural, functional, and metabolic information. It involves target site …See details»
A dual diffusion model enables 3D molecule generation and lead ...
Mar 26, 2024 · PMDM consists of a conditional equivariant diffusion model with both local and global molecular dynamics, enabling PMDM to consider the conditioned protein information to …See details»
Fully Flexible Molecular Alignment Enables Accurate Ligand …
Jul 29, 2024 · Accurate protein–ligand binding poses are the prerequisites of structure-based binding affinity prediction and provide the structural basis for in-depth lead optimization in …See details»
Model-Based Lead Molecule Design | SpringerLink
Apr 21, 2017 · Designing a lead molecule for optimization involves a complex phase in which researchers look for compounds that satisfy pharmaceutical properties and can then be …See details»
Machine learning-aided generative molecular design - Nature
Jun 18, 2024 · Here we provide a comprehensive overview of the current state of the art in molecular design using machine learning models as well as important design decisions, such …See details»
Editorial: Discovery of small molecule lead compounds: A driving …
In this editorial, we summarize the main findings and perspectives detailed within each of the accepted articles. Zhao et al. designed and synthesized a series of bifunctional small molecule …See details»
Lead-like Drugs: A Perspective | Journal of Medicinal Chemistry
Jul 27, 2018 · To examine the recent state-of-the-art in lead-like drug discovery, we surveyed recent drug approvals from 2011 to 2017 and top 200 prescribed medications, as well as …See details»
A unified lead-oriented synthesis of over fifty molecular scaffolds
A unified synthetic approach is described that enabled the synthesis of 52 diverse lead-like molecular scaffolds from a minimal set of 13 precursors. The divergent approach exploited a …See details»
Lead - Wikipedia
Lead is a neurotoxin that accumulates in soft tissues and bones. It damages the nervous system and interferes with the function of biological enzymes, causing neurological disorders ranging …See details»
Rational Molecular Editing: A New Paradigm in Drug Discovery
Jun 21, 2024 · Molecular editing consists of alchemical-looking reactions which selectively prune, insert, exchange, or modify atoms or functional groups (FGs) in highly elaborated compounds. …See details»
PocketFlow is a data-and-knowledge-driven structure-based …
Mar 11, 2024 · We herein propose a structure-based molecular generative framework with chemical knowledge explicitly considered (named PocketFlow), which generates novel ligand …See details»
Lead identification and optimization - ScienceDirect
Jan 1, 2021 · Lead compound is a chemical compound or natural product that has biological activity against a drug target. Lead identification and optimization is a crucial step in the drug …See details»
Molecule–Lead Coupling at Molecular Junctions: Relation between …
Using a “site-to-state” transformation that provides direct access to the coupling matrix elements between the molecular states and the eigenstate manifold of each lead, we find coupling …See details»
Standard Atomic Weight of Lead Revised - IUPAC
May 6, 2021 · Following the recent publication of the IUPAC Technical Report on the variation of lead isotopic composition and atomic weight in terrestrial materials [1], the IUPAC Commission …See details»
8.7.7: Chemistry of Lead (Z=82) - Chemistry LibreTexts
Although lead is not very common in the earth's crust, what is there is readily available and easy to refine. Its chief use today is in lead-acid storage batteries such as those used in …See details»
Hierarchically oriented organization in supramolecular peptide
Sep 10, 2019 · Most importantly, we propose the concept of hierarchically oriented organization for self-assembling peptide crystals, distinct from the traditional growth mechanism of …See details»