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Application

Discovery Studio 0.8689644814898251 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0689689992931435 Amorphous Cell 0.2862768857921842 Blends 0.0025244875290316065 CASTEP 0.3995758860951227 CDOCKER 0.1503584772291225 CHARMm 0.23659497122084217 COMPASS 0.37251337978390386 COMPASS III 0.08512571947894577 COSMObase 0.0036352620418055137 COSMOconf 0.004241139048773099 COSMOmic 1.0097950116126426E-4 COSMOperm 0.0013127335150964355 COSMOplex 2.0195900232252852E-4 COSMOquick 0.0014137130162576996 COSMOtherm 0.06452590124204786 Cantera 0.0 Catalyst 0.10754316873674644 Classical Simulations 1.0 Conformers 7.068565081288498E-4 Crystallization 0.07613854387559325 DFTB Plus 0.005856811067353327 DMol3 0.17964253256588913 DPD 0.0028274260325153993 Discover 0.003534282540644249 Forcite 0.5508431788346966 GULP 0.024840957285671008 Kinetix 2.0195900232252852E-4 LUDI 0.003433303039482985 LibDock 0.06311218822579016 LigandFit 0.004645057053418156 MCSS 4.0391800464505703E-4 MODELER 0.1833787741088559 MesoDyn 0.0010097950116126427 Mesocite 0.003736241542966778 Mesoscale 0.0069675855801272345 Modules 0.0 Morphology 0.018176310209027567 ONETEP 0.0011107745127739068 Polymorph 0.001918610522064021 QMERA 2.0195900232252852E-4 QSAR 0.0011107745127739068 Quantum Mechanics 0.5679087145309503 Reflex 0.05543774613753408 Reflex Plus 9.088155104513784E-4 Semi-empirical 0.0077754215894173485 Sorption 0.0573563566595981 Synthia 0.001514692517418964 TURBOMOLE 5.048975058063213E-4 VAMP 0.001514692517418964 Visualization 0.7512874886398061 X-Cell 0.0013127335150964355 ZDOCK 0.02605271129960618

Year

2022 0.02198768689533861 2023 0.29454705364995604 2024 0.6678979771328056 2025 1.0 2026 0.3738786279683377 2027 0.0

Keywords

target 1.0 potential 0.2786615469007131 docking 0.19948802340464436 analysis 0.1911684037301152 visualization 0.1816145547632108 between 0.1584384713841653 energy 0.09759553848966904 novel 0.09732126531358566 cell 0.06646553300420552 binding 0.06271713293106601 promising 0.0614829036386908 activity 0.04516364966172975 stability 0.04031815688425672 performance 0.03912963978789541 experimental 0.03277564454196379 interaction 0.03236423477783873 synthesized 0.028295849332601937 effective 0.021530444322545254 mechanism 0.021027610166392395 development 0.018239166209544706 including 0.018010605229475223 synthesis 0.00758822453830682 protein 0.007222526970195649 design 9.599561162918266E-4 chemical 0.0
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