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Application

Discovery Studio 1.0 Materials Studio 0.9740999740999741 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06584831214379658 Amorphous Cell 0.2780359491451118 Blends 0.0024550635686102587 CASTEP 0.4031565103024989 CDOCKER 0.17430951337132836 CHARMm 0.26199035510740903 COMPASS 0.36519070583077595 COMPASS III 0.07873739587900044 COSMObase 0.0032441911442349846 COSMOconf 0.0037702761946514685 COSMOmic 8.768084173608067E-5 COSMOperm 0.00131521262604121 COSMOplex 2.63042525208242E-4 COSMOquick 0.00131521262604121 COSMOtherm 0.06427005699254713 Cantera 8.768084173608067E-5 Catalyst 0.12222709338009645 Classical Simulations 1.0 Conformers 8.768084173608067E-4 Crystallization 0.0734765453748356 DFTB Plus 0.006137658921525646 DMol3 0.1818500657606313 DPD 0.002893467777290662 Discover 0.004384042086804033 Forcite 0.5297676457693994 GULP 0.02533976326172731 Kinetix 1.7536168347216134E-4 LUDI 0.00526085050416484 LibDock 0.07181060938185006 LigandFit 0.00657606313020605 MCSS 0.0012275317843051293 MODELER 0.19850942569048663 MesoDyn 0.0014905743095133712 Mesocite 0.003857957036387549 Mesoscale 0.007277509864094696 Modules 0.0 Morphology 0.018062253397632618 ONETEP 9.644892590968873E-4 Polymorph 0.0020166593599298555 QMERA 1.7536168347216134E-4 QSAR 0.00131521262604121 Quantum Mechanics 0.5729066199035511 Reflex 0.05295922840859272 Reflex Plus 7.89127575624726E-4 Semi-empirical 0.008154318281455502 Sorption 0.05418676019289785 Synthia 0.0014905743095133712 TURBOMOLE 5.26085050416484E-4 VAMP 0.0016659359929855327 Visualization 0.8732135028496274 X-Cell 0.0012275317843051293 ZDOCK 0.029811486190267425

Year

2020 0.020160225371951758 2021 0.13099744695835902 2022 0.1570560788801831 2023 0.3988907474249494 2024 0.7956686328021833 2025 1.0 2026 0.3742406902016023 2027 0.0

Keywords

target 1.0 potential 0.2692365213489868 docking 0.21902340536902715 visualization 0.21046137740222837 analysis 0.18301802138637555 between 0.14944290735063187 novel 0.09956629028639796 energy 0.08072235100575786 binding 0.06924399910266955 cell 0.0574665370522695 activity 0.051596500411276454 promising 0.04808195618036342 interaction 0.03499588723547446 synthesized 0.027966798773648396 experimental 0.026994690794885215 stability 0.026845135721229343 protein 0.01951693711209153 performance 0.01701188962835564 development 0.016002392881178495 mechanism 0.015067673670829283 effective 0.014357287070963882 synthesis 0.010693187766394975 including 0.009795857324459731 design 3.36498915725716E-4 chemical 0.0
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