Mostrando ítems 1-6 de 6
Falaguera Mata, Maria José (Fecha de defensa: 2022-04-26)
Systems pharmacology is the discipline that studies the so-called ‘pharmacological space’ with a holistic and network-based perspective. Its challenge is to shed light on the astonishingly sophisticated ...
Remez Vinogradov, Nikita (Fecha de defensa: 2016-02-08)
The explosion of reductionist approaches at the end of the XXth century allowed for fast and high-throughput data collection in pharmaceutical industry, but did not deliver the expected gain in drug ...
Cornet Bartolomé, Carles (Fecha de defensa: 2020-01-17)
High drug attrition rate during clinical and post market phases is one of the major factors contributing to the pharmaceutical industry productivity crisis. This problem is especially worrisome in the ...
Martínez Rosell, Gerard (Fecha de defensa: 2017-12-20)
In this thesis we apply molecular dynamics (MD) simulations and other in silico techniques in drug discovery. Specifically, (a) we developed an algorithm to detect cryptic pockets based on MD simulations ...
Jalencas i Giménez, Xavier (Fecha de defensa: 2013-09-17)
In medicinal chemistry, two chemical fragments are considered bioisosteric if they bind to the same protein environment. Accordingly, looking at the same players from an opposite perspective, two protein ...
Carrascosa Baena, María Carmen (Fecha de defensa: 2018-03-20)
El paradigma clàssic on un medicament interacciona amb un únic target biològic vinculat a una malaltia es posa en dubte. Actualment es reconeix que un medicament interacciona amb múltiples targets ...