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Application

Discovery Studio 1.0 Materials Studio 0.9704882654437551 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06790214974054855 Amorphous Cell 0.2758339510748703 Blends 0.0028910303928836173 CASTEP 0.410229799851742 CDOCKER 0.1787991104521868 CHARMm 0.2600444773906597 COMPASS 0.37361008154188285 COMPASS III 0.07227575982209043 COSMObase 0.0028910303928836173 COSMOconf 0.0032616753150481836 COSMOmic 2.2238695329873981E-4 COSMOperm 0.0012601927353595255 COSMOplex 3.7064492216456633E-4 COSMOquick 0.0016308376575240918 COSMOtherm 0.06323202372127502 Cantera 0.0 Catalyst 0.12142327650111194 Classical Simulations 1.0 Conformers 0.0011860637509266123 Crystallization 0.07613046701260193 DFTB Plus 0.005782060785767235 DMol3 0.18851000741289844 DPD 0.0031875463306152707 Discover 0.004670126019273536 Forcite 0.531578947368421 GULP 0.026908821349147516 Kinetix 2.2238695329873981E-4 LUDI 0.005485544848035582 LibDock 0.07160859896219422 LigandFit 0.008005930318754633 MCSS 0.0012601927353595255 MODELER 0.19184581171237955 MesoDyn 0.0015567086730911787 Mesocite 0.004521868050407709 Mesoscale 0.008080059303187547 Modules 0.0 Morphology 0.01771682727946627 ONETEP 0.0013343217197924388 Polymorph 0.001927353595255745 QMERA 2.2238695329873981E-4 QSAR 0.0014084507042253522 Quantum Mechanics 0.5865826538176427 Reflex 0.05618977020014826 Reflex Plus 7.412898443291327E-4 Semi-empirical 0.007857672349888807 Sorption 0.05396590066716086 Synthia 0.0014084507042253522 TURBOMOLE 5.189028910303929E-4 VAMP 0.0017049666419570052 Visualization 0.8896219421793922 X-Cell 0.0011860637509266123 ZDOCK 0.030689399555226093

Year

2020 0.05818815331010453 2021 0.20252613240418119 2022 0.3 2023 0.4776132404181185 2024 1.0 2025 0.9955574912891986 2026 0.3702961672473868 2027 0.0

Keywords

target 1.0 potential 0.2571277882915025 docking 0.21505910092141595 visualization 0.21322867868333695 analysis 0.1752551732696305 between 0.15121149132876244 novel 0.09977352402816989 energy 0.08025936152390407 binding 0.06902863524958892 cell 0.0572704991778612 activity 0.052709955635528806 promising 0.04185151862997549 interaction 0.039865975863245744 synthesized 0.02813886389724816 experimental 0.02705302019669283 stability 0.024167778363788663 protein 0.019762355350107032 mechanism 0.017373499208885305 effective 0.015946390345298298 development 0.015263860019234946 performance 0.012843979772283064 synthesis 0.012440666397791084 including 0.005770483665808333 chemical 0.0013960847578568549 design 0.0
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