En el post anterior, ya logramos obtener todos los archivos de configuración y nos encontramos con un problema. Requeria comandos de linux para modificar algunos textos.En especifico era el enunciado del uso tr read system values written by CHARMM (need to convert uppercases to lowercases)exec tr “[:upper:]” “[:lower:]” < ../step3_pbcsetup.str | sed -e “s/ =//g” […]
Software
Clinical Trial Outcomes Databases
Along the development path of a compound, sponsors make critical decisions to ensure drug approval and market success.
Locating Binding Sites in Protein Structures
Paul Labute and Martin SantavyChemical Computing Group Inc.Introduction | Methodology | Results | Summary | References Introduction Active sites in proteins are usually hydrophobic pockets that involve sidechain atoms. It is non-trivial to quantify this rule of thumb. Methods such as [Goodford 1985] or [Miranker 1991] use interaction energies between the receptor and different probes in an […]
Lector PDF con asistente de traducción
Les dejo este programita que encontre “FOXIT READER” bastante útil pues puede ir traduciendo el texto que vas seleccionando o todo el documento. Excelente herramienta cuando tienes que leer papers por montón. https://www.foxitsoftware.com/downloads/ https://www.foxitsoftware.com/downloads/
Diseño molecular
http://www.ccp4.ac.uk/MG/
Foldit
https://fold.it/portal/
Mindset Kit
“Providing learning mindset resources directly to a wide audience to help them adopt practices and improve student achievement” The Mindset Kit was created by The Project for Education Research that Scales (PERTS), a research center in the psychology department at Stanford University. Our goal is to create a place where educators and parents can learn […]
ChemDraw Ultra 12
Esta excelente suite de dibujo incluye ChemDraw ultra 12.0, ChemDraw/Excel 12.0 (W), MNova Std/lite (W), Chem3D pro 12.0 (W), ChemBioFinder Std 12.0 (W), Controles profesionales y plugins de ChemDraw y Chem3D ActiveX (W), ChemBioFinder/Office 12.0 (W) y las Bases de Datos ChemINDEX (Index, RXN, NCI y SIDA). Descargar