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Application

Discovery Studio 1.0 Materials Studio 0.9116655428186109 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059482758620689656 Amorphous Cell 0.2761494252873563 Blends 0.002011494252873563 CASTEP 0.3054597701149425 CDOCKER 0.17614942528735633 CHARMm 0.2867816091954023 COMPASS 0.33017241379310347 COMPASS III 0.10459770114942529 COSMObase 0.005172413793103448 COSMOconf 0.0066091954022988505 COSMOmic 0.0 COSMOperm 5.747126436781609E-4 COSMOplex 2.8735632183908046E-4 COSMOquick 0.0011494252873563218 COSMOtherm 0.06350574712643678 Catalyst 0.07844827586206897 Classical Simulations 1.0 Conformers 2.8735632183908046E-4 Crystallization 0.07155172413793104 DFTB Plus 0.0022988505747126436 DMol3 0.14166666666666666 DPD 0.0011494252873563218 Discover 0.004597701149425287 Forcite 0.5126436781609195 GULP 0.015517241379310345 Kinetix 0.0 LUDI 0.004597701149425287 LibDock 0.07442528735632184 LigandFit 0.004022988505747126 MCSS 2.8735632183908046E-4 MODELER 0.2738505747126437 MesoDyn 5.747126436781609E-4 Mesocite 0.003160919540229885 Mesoscale 0.004885057471264368 Morphology 0.016666666666666666 ONETEP 5.747126436781609E-4 Polymorph 0.0017241379310344827 QMERA 2.8735632183908046E-4 QSAR 2.8735632183908046E-4 Quantum Mechanics 0.4385057471264368 Reflex 0.052298850574712646 Reflex Plus 0.0 Semi-empirical 0.004022988505747126 Sorption 0.05574712643678161 Synthia 5.747126436781609E-4 TURBOMOLE 0.0 VAMP 8.620689655172414E-4 Visualization 0.7212643678160919 X-Cell 0.0011494252873563218 ZDOCK 0.03103448275862069

Year

2024 0.2788891503883267 2025 1.0 2026 0.8797364085667215 2027 0.0

Keywords

target 1.0 potential 0.3236721873215306 docking 0.2420045688178184 analysis 0.22515705311250714 visualization 0.17175899486007995 between 0.13906339234723014 novel 0.09494574528840663 promising 0.09137635636778983 binding 0.08737864077669903 energy 0.06310679611650485 cell 0.05768132495716733 activity 0.04954311821816105 stability 0.039548829240434034 performance 0.02541404911479155 including 0.025128498001142203 strong 0.020702455739577384 development 0.014563106796116505 effective 0.013706453455168474 mechanism 0.01070816676185037 synthesized 0.00885208452312964 enhanced 0.006853226727584237 interaction 0.004283266704740148 protein 0.002141633352370074 experimental 0.0 therapeutic 0.0
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