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Application

Discovery Studio 1.0 Materials Studio 0.5579119086460033 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0979020979020979 Amorphous Cell 0.2773892773892774 Blends 0.002331002331002331 CASTEP 0.11655011655011654 CDOCKER 0.1655011655011655 CHARMm 0.36363636363636365 COMPASS 0.2937062937062937 COMPASS III 0.09324009324009325 COSMObase 0.002331002331002331 COSMOconf 0.0 COSMOquick 0.002331002331002331 COSMOtherm 0.04428904428904429 Catalyst 0.08857808857808858 Classical Simulations 1.0 Crystallization 0.037296037296037296 DFTB Plus 0.0 DMol3 0.08391608391608392 Discover 0.0 Forcite 0.47086247086247085 GULP 0.011655011655011656 LibDock 0.07226107226107226 LigandFit 0.002331002331002331 MODELER 0.3006993006993007 Mesocite 0.002331002331002331 Mesoscale 0.002331002331002331 Morphology 0.013986013986013986 QMERA 0.0 Quantum Mechanics 0.19114219114219114 Reflex 0.02097902097902098 Semi-empirical 0.002331002331002331 Sorption 0.046620046620046623 Visualization 0.675990675990676 X-Cell 0.0 ZDOCK 0.07459207459207459

Year

2024 0.21726190476190477 2025 1.0 2026 0.0

Keywords

interaction 1.0 target 0.9276546091015169 between 0.41890315052508753 docking 0.3547257876312719 potential 0.34655775962660446 analysis 0.2952158693115519 binding 0.2322053675612602 visualization 0.1516919486581097 energy 0.10151691948658109 stability 0.08751458576429405 protein 0.07467911318553092 mechanism 0.06884480746791131 promising 0.06417736289381563 novel 0.06301050175029171 strong 0.057176196032672114 cell 0.049008168028004666 including 0.049008168028004666 therapeutic 0.03733955659276546 development 0.030338389731621937 activity 0.029171528588098017 experimental 0.021003500583430573 effective 0.015169194865810968 drug 0.014002333722287048 complex 0.002333722287047841 role 0.0
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