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Application

Discovery Studio 1.0 Materials Studio 0.703328509406657 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.05542986425339366 Amorphous Cell 0.17307692307692307 Blends 0.0011312217194570137 CASTEP 0.3834841628959276 CDOCKER 0.21040723981900453 CHARMm 0.29524886877828055 COMPASS 0.2850678733031674 COMPASS III 0.053167420814479636 COSMObase 0.0011312217194570137 COSMOconf 0.003393665158371041 COSMOperm 0.0022624434389140274 COSMOplex 0.0 COSMOtherm 0.0757918552036199 Catalyst 0.12104072398190045 Classical Simulations 0.8744343891402715 Crystallization 0.06447963800904978 DFTB Plus 0.004524886877828055 DMol3 0.16968325791855204 DPD 0.0 Discover 0.0011312217194570137 Forcite 0.4072398190045249 GULP 0.04072398190045249 Kinetix 0.0 LUDI 0.006787330316742082 LibDock 0.083710407239819 LigandFit 0.013574660633484163 MODELER 0.22963800904977374 MesoDyn 0.0011312217194570137 Mesocite 0.0 Mesoscale 0.003393665158371041 Morphology 0.007918552036199095 Polymorph 0.0022624434389140274 QSAR 0.0 Quantum Mechanics 0.5441176470588235 Reflex 0.053167420814479636 Semi-empirical 0.006787330316742082 Sorption 0.033936651583710405 Synthia 0.0011312217194570137 VAMP 0.0011312217194570137 Visualization 1.0 ZDOCK 0.02828054298642534

Year

2020 0.0 2021 0.30303030303030304 2022 0.296969696969697 2023 0.4206060606060606 2024 1.0 2025 0.7503030303030302 2026 0.21333333333333335

Keywords

well 1.0 target 0.949556282111163 potential 0.2769733769266698 docking 0.26015880429705746 visualization 0.220457730032695 analysis 0.16160672582905183 between 0.13264829518916393 novel 0.09014479215319944 binding 0.08407286314806166 activity 0.06632414759458197 energy 0.03269500233535731 promising 0.026156001868285848 experimental 0.025688930406352173 protein 0.022419430172816442 synthesized 0.01821578701541336 including 0.017281644091546006 interaction 0.014946286781877626 cell 0.009808500700607193 development 0.006071929005137786 stability 0.002335357309668379 synthesis 0.002335357309668379 effective 4.6707146193367583E-4 mechanism 4.6707146193367583E-4 vitro 4.6707146193367583E-4 drug 0.0
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