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Application

Discovery Studio 1.0 Materials Studio 0.9857415119644244 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06700355605465094 Amorphous Cell 0.27802732547258097 Blends 0.0025266704098820887 CASTEP 0.3888265019651881 CDOCKER 0.1689125959198952 CHARMm 0.2597791502900992 COMPASS 0.3635597978663672 COMPASS III 0.08094703350177802 COSMObase 0.0034624742653939734 COSMOconf 0.004023956578701104 COSMOmic 9.358038555118848E-5 COSMOperm 0.0013101253977166386 COSMOplex 2.8074115665356543E-4 COSMOquick 0.0013101253977166386 COSMOtherm 0.06232453677709152 Cantera 0.0 Catalyst 0.1282987085906794 Classical Simulations 1.0 Conformers 7.486430844095078E-4 Crystallization 0.07458356728429721 DFTB Plus 0.005614823133071308 DMol3 0.17555680329402956 DPD 0.002807411566535654 Discover 0.003836795807598727 Forcite 0.531817331087404 GULP 0.02498596294216732 Kinetix 2.8074115665356543E-4 LUDI 0.004679019277559424 LibDock 0.07177615571776155 LigandFit 0.005708403518622496 MCSS 6.550626988583193E-4 MODELER 0.18388545760808533 MesoDyn 0.0013101253977166386 Mesocite 0.004117536964252292 Mesoscale 0.0072992700729927005 Modules 0.0 Morphology 0.017873853640276997 ONETEP 0.001029384241063073 Polymorph 0.0019651880965749578 QMERA 1.8716077110237696E-4 QSAR 0.001029384241063073 Quantum Mechanics 0.553621560920831 Reflex 0.05427662361968931 Reflex Plus 8.422234699606962E-4 Semi-empirical 0.007580011229646266 Sorption 0.05530600786075238 Synthia 0.001590866554370204 TURBOMOLE 5.614823133071309E-4 VAMP 0.001590866554370204 Visualization 0.8497099008047914 X-Cell 0.0013101253977166386 ZDOCK 0.02994572337638031

Year

2021 0.0028099754127151387 2022 0.17079381805409202 2023 0.37074113101510364 2024 0.7282226905514577 2025 1.0 2026 0.3732876712328767 2027 0.0

Keywords

target 1.0 potential 0.27802108678021087 docking 0.22230332522303325 visualization 0.20904298459042986 analysis 0.18888888888888888 between 0.15287915652879155 novel 0.10150040551500406 energy 0.08483373884833739 binding 0.07331711273317112 cell 0.06208434712084347 promising 0.05478507704785077 activity 0.053771289537712895 interaction 0.037631792376317925 stability 0.03434712084347121 synthesized 0.031184103811841037 experimental 0.028548256285482562 performance 0.024493106244931062 protein 0.021816707218167072 development 0.019545823195458233 effective 0.019505271695052718 mechanism 0.019099756690997567 including 0.015369018653690187 synthesis 0.013828061638280617 design 0.0023519870235198703 chemical 0.0
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