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Application

Discovery Studio 0.9408693382065004 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06258212877792378 Amorphous Cell 0.28580814717477004 Blends 0.0019710906701708277 CASTEP 0.34888304862023656 CDOCKER 0.15949408672798948 CHARMm 0.2554204993429698 COMPASS 0.35036136662286466 COMPASS III 0.10019710906701708 COSMObase 0.004434954007884363 COSMOconf 0.005584756898817346 COSMOmic 0.0 COSMOperm 4.927726675427069E-4 COSMOplex 1.64257555847569E-4 COSMOquick 0.0016425755584756898 COSMOtherm 0.0652102496714849 Catalyst 0.08377135348226018 Classical Simulations 1.0 Conformers 3.28515111695138E-4 Crystallization 0.07128777923784495 DFTB Plus 0.004434954007884363 DMol3 0.15653745072273326 DPD 0.0021353482260183967 Discover 0.0036136662286465177 Forcite 0.5377792378449409 GULP 0.020203679369250986 Kinetix 1.64257555847569E-4 LUDI 0.0034494086727989487 LibDock 0.06750985545335085 LigandFit 0.0037779237844940868 MCSS 4.927726675427069E-4 MODELER 0.2462220762155059 MesoDyn 6.57030223390276E-4 Mesocite 0.0031208935611038106 Mesoscale 0.005584756898817346 Modules 0.0 Morphology 0.0164257555847569 ONETEP 8.212877792378449E-4 Polymorph 0.0019710906701708277 QMERA 1.64257555847569E-4 QSAR 6.57030223390276E-4 Quantum Mechanics 0.49556504599211565 Reflex 0.05174113009198423 Reflex Plus 9.855453350854138E-4 Semi-empirical 0.005913272010512484 Sorption 0.056340341655716164 Synthia 9.855453350854138E-4 TURBOMOLE 3.28515111695138E-4 VAMP 9.855453350854138E-4 Visualization 0.7028580814717477 X-Cell 0.001478318002628121 ZDOCK 0.02759526938239159

Year

2023 0.0022935779816513763 2024 0.5045871559633027 2025 1.0 2026 0.5411569826707442 2027 0.0

Keywords

target 1.0 potential 0.2960885148823438 analysis 0.20874240299205235 docking 0.2081190587501948 visualization 0.16316035530621786 between 0.15194015895278168 novel 0.09568334112513635 energy 0.08352812840891383 promising 0.07737260402057036 binding 0.06778868630201028 cell 0.06358111266947171 activity 0.04456911329281596 performance 0.0419978182951535 stability 0.0401277855695808 including 0.0200249337696743 experimental 0.018934081346423562 synthesized 0.018154901044101605 effective 0.01729780271154745 mechanism 0.015661524076671342 development 0.014882343774349384 interaction 0.014882343774349384 enhanced 0.009583917718560075 protein 0.0021037868162692847 strong 0.0012466884837151317 design 0.0
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