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Application

Discovery Studio 1.0 Materials Studio 0.919754543308945 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06555537746433723 Amorphous Cell 0.2734412566116365 Blends 0.002404231447347331 CASTEP 0.3564673825933643 CDOCKER 0.18047764064753968 CHARMm 0.2804936688571886 COMPASS 0.3497355345407918 COMPASS III 0.07853822728001282 COSMObase 0.0027247956403269754 COSMOconf 0.004327616605225197 COSMOmic 1.6028209648982208E-4 COSMOperm 9.616925789389325E-4 COSMOplex 1.6028209648982208E-4 COSMOquick 0.0011219746754287546 COSMOtherm 0.058182401025805415 Cantera 0.0 Catalyst 0.12373777849014266 Classical Simulations 1.0 Conformers 9.616925789389325E-4 Crystallization 0.07340920019233851 DFTB Plus 0.003686488219265908 DMol3 0.1625260458406796 DPD 0.002243949350857509 Discover 0.00384677031575573 Forcite 0.5247635839076775 GULP 0.020516108350697226 Kinetix 1.6028209648982208E-4 LUDI 0.005609873377143773 LibDock 0.07340920019233851 LigandFit 0.006411283859592883 MCSS 0.0012822567719185766 MODELER 0.2001923385157878 MesoDyn 0.0011219746754287546 Mesocite 0.0040070524122455525 Mesoscale 0.006731848052572527 Morphology 0.017310466420900786 ONETEP 9.616925789389325E-4 Polymorph 0.0012822567719185766 QMERA 1.6028209648982208E-4 QSAR 8.014104824491104E-4 Quantum Mechanics 0.5103381952235935 Reflex 0.05417534861355987 Reflex Plus 3.2056419297964416E-4 Semi-empirical 0.005449591280653951 Sorption 0.051771117166212535 Synthia 6.411283859592883E-4 TURBOMOLE 6.411283859592883E-4 VAMP 0.0012822567719185766 Visualization 0.8377945183523 X-Cell 0.0014425388684083987 ZDOCK 0.03125500881551531

Year

2021 0.0 2022 0.1540763968072976 2023 0.30572976054732043 2024 0.5799600912200684 2025 1.0 2026 0.43814139110604333 2027 0.001282782212086659

Keywords

target 1.0 potential 0.29081058260624826 docking 0.23620883760202646 visualization 0.21024486349563748 analysis 0.1988460455952716 between 0.14783281733746131 novel 0.1075147762454264 binding 0.08422459893048129 energy 0.07620320855614973 cell 0.06304531381930763 promising 0.060582606248240925 activity 0.05692372642837039 stability 0.03848860118209963 interaction 0.037222065859836756 synthesized 0.027582324795947088 protein 0.02638615254714326 effective 0.022867998874190824 including 0.02265690965381368 mechanism 0.02216436813960034 performance 0.021742189698846046 experimental 0.02103855896425556 development 0.020686743596960315 synthesis 0.015479876160990712 design 0.004925415142133408 compound 0.0
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