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Application

Discovery Studio 0.9716192687173535 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06824229143840976 Amorphous Cell 0.263656284238535 Antibody 1.5651901706057285E-4 Blends 0.0030521208326811707 CASTEP 0.4272969165753639 CDOCKER 0.18531851619971826 CHARMm 0.27422131789012366 COMPASS 0.36805446861793706 COMPASS III 0.061903271247456565 COSMObase 0.0025825637814994524 COSMOconf 0.0030521208326811707 COSMOmic 3.130380341211457E-4 COSMOperm 0.0010956331194240101 COSMOplex 3.130380341211457E-4 COSMOquick 0.0017999686961965879 COSMOtherm 0.06659884175927375 Cantera 0.0 Catalyst 0.1429801220848333 Classical Simulations 1.0 Conformers 0.0014869306620754422 Crystallization 0.07904210361558929 DFTB Plus 0.005008608545938331 DMol3 0.20339646267021444 DPD 0.004304272969165753 Discover 0.007512912818907497 Forcite 0.5083737674127407 GULP 0.029738613241508845 Kinetix 1.5651901706057285E-4 LUDI 0.00813898888714979 LibDock 0.07027703866019722 LigandFit 0.014947566129284709 MCSS 0.001643449679136015 MODELER 0.24096102676475192 MesoDyn 0.0017999686961965879 Mesocite 0.005556425105650337 Mesoscale 0.010095476600406949 Modules 0.0 Morphology 0.018469244013147597 ONETEP 0.0019564877132571606 Polymorph 0.0019564877132571606 QMERA 3.912975426514322E-4 QSAR 0.001643449679136015 Quantum Mechanics 0.6180935983722022 Reflex 0.05838159336359368 Reflex Plus 0.0010956331194240101 Reflex QPA 0.0 Semi-empirical 0.007825950853028642 Sorption 0.051886054155579904 Synthia 8.608545938331507E-4 TURBOMOLE 7.825950853028644E-4 VAMP 0.0022695257473783065 Visualization 0.7782125528251682 X-Cell 0.0014086711535451558 ZDOCK 0.030364689309751135

Year

2015 0.0 2016 0.07560137457044673 2017 0.09553264604810996 2018 0.1108820160366552 2019 0.12623138602520045 2020 0.14306987399770904 2021 0.2600229095074456 2022 0.4979381443298969 2023 0.5741122565864833 2024 0.815922107674685 2025 1.0 2026 0.4859106529209622 2027 6.872852233676976E-4

Keywords

target 1.0 potential 0.22672881131825995 docking 0.18418616950945393 visualization 0.17592225307417692 analysis 0.1585349728943541 between 0.15665079994711092 novel 0.09632420996958879 energy 0.08181277270924237 binding 0.06412799153774958 cell 0.056194631759883644 activity 0.052690731191326196 interaction 0.03864207325135528 promising 0.03612984265503107 experimental 0.03374983472167129 synthesized 0.02657675525585085 mechanism 0.0234695226761867 stability 0.016891445193706202 protein 0.016362554541848474 performance 0.011635594340870026 development 0.010081978051037948 synthesis 0.010081978051037948 chemical 0.007999471109348143 effective 0.007966415443607034 design 0.0073714134602670895 including 0.0
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