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Application

Discovery Studio 1.0 Materials Studio 0.45609220636663006 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.059961315280464215 Amorphous Cell 0.14990328820116053 Blends 0.0014506769825918763 CASTEP 0.32011605415860733 CDOCKER 0.19100580270793036 CHARMm 0.34332688588007737 COMPASS 0.18617021276595744 COMPASS III 0.04642166344294004 COSMObase 0.0029013539651837525 COSMOconf 0.0033849129593810446 COSMOmic 0.0 COSMOperm 9.671179883945841E-4 COSMOplex 0.0 COSMOquick 0.0 COSMOtherm 0.05029013539651837 Catalyst 0.11508704061895551 Classical Simulations 0.7422630560928434 Conformers 0.0 Crystallization 0.02611218568665377 DFTB Plus 0.004352030947775629 DMol3 0.10880077369439071 DPD 4.8355899419729207E-4 Discover 9.671179883945841E-4 Forcite 0.2741779497098646 GULP 0.014506769825918761 Kinetix 0.0 LUDI 0.004835589941972921 LibDock 0.09235976789168278 LigandFit 0.0019342359767891683 MODELER 0.32350096711798837 MesoDyn 0.0 Mesocite 0.0019342359767891683 Mesoscale 0.0029013539651837525 Modules 0.0 Morphology 0.005802707930367505 Polymorph 9.671179883945841E-4 QMERA 0.0 QSAR 0.0014506769825918763 Quantum Mechanics 0.4197292069632495 Reflex 0.016924564796905222 Reflex Plus 4.8355899419729207E-4 Semi-empirical 0.004835589941972921 Sorption 0.02756286266924565 Synthia 4.8355899419729207E-4 Visualization 1.0 X-Cell 0.0014506769825918763 ZDOCK 0.03239845261121857

Year

2022 3.937007874015748E-4 2023 0.2141732283464567 2024 0.6543307086614173 2025 1.0 2026 0.34606299212598424 2027 0.0

Keywords

analysis 1.0 target 0.92861695347355 potential 0.41852560016995966 docking 0.4083280220947525 visualization 0.24792861695347354 binding 0.1574251115360102 between 0.13872955173146378 novel 0.082855321861058 promising 0.07541958784788613 activity 0.07053324835351604 protein 0.06755895474824729 stability 0.058636073932441045 interaction 0.05417463352453792 including 0.04801359677076694 silico 0.04355215636286382 therapeutic 0.033991926917357126 energy 0.026556192904185257 vitro 0.014659018483110261 strong 0.012959422137242405 mechanism 0.009560229445506692 treatment 0.006798385383471425 drug 0.005098789037603569 compound 0.0019120458891013384 development 0.0 effective 0.0
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